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Process Data set: Acetic acid production; technology mix; production mix, at plant; 100% active substance (en) en

A more recent version of this data set exists in the database.

Most recent version of this data set:04.02.000

Key Data Set Information
Location RER
Reference year 2017
Name
Base name ; Treatment, standards, routes ; Mix and location types ; Quantitative product or process properties
Acetic acid production; technology mix; production mix, at plant; 100% active substance
Classification
Class name : Hierarchy level
  • ILCD: Materials production / Organic chemicals
General comment on data set TYPE OF DATASET For every chemical compound three datasets are created; the unit process (partially terminated system), the non-energy and transport component of the partially terminated system, and the cumulative life cycle inventory dataset (system process). For more information and flow chart see the report (ecoinvent, 2017, Data on the Production of Chemicals created for the EU Product Environmental Footprint (PEF) pilot phase implementation, www.ecoinvent.org, ecoinvent Association, Z\xc3\xbcrich, Switzerland). This dataset represent the cumulative life cycle inventory dataset (system process). PROCESS DESCRIPTION This dataset represents the production of acetic acid using the Celanese process. Acetic acid is a clear, colorless, corrosive liquid that has a pungent vinegar-like odor. It is mainly used for the production of vinyl acetate and acetic anhydride. In the Celanese process (which was developed based on the Monsanto process), acetic acid is produced by carbonylation of methanol, using rhodium as catalyst (Le Berre et al. 2014). The activity starts when the raw materials enter the process. This activity ends with the production of acetic acid. The dataset includes the production process, including refining. References ecoinvent (2017) Data on the Production of Chemicals created for the EU Product Environmental Footprint (PEF) pilot phase implementation, www.ecoinvent.org, ecoinvent Association, Z\xc3\xbcrich, Switzerland Gendorf (2016) Umwelterkl\xc3\xa4rung 2015, Werk Gendorf Industriepark, www.gendorf.de Le Berre, C., Serp, P., Kalck, P. and Torrence, G. P. 2014. Acetic Acid. Ullmann's Encyclopedia of Industrial Chemistry. Althaus H.-J., Chudacoff M., Hischier R., Jungbluth N., Osses M. and Primas A. (2007) Life Cycle Inventories of Chemicals. ecoinvent report No. 8, v2.0. EMPA D\xc3\xbcbendorf, Swiss Centre for Life Cycle Inventories, D\xc3\xbcbendorf, CH. Water content of the reference product: 0.0 kg Biogenic carbon content of the reference product: 0.0 kg DATA QUALITY ASSESSMENT The data quality ratings for the datasets were determined as the average of the 5 individual ratings for Technological Representativeness, Geographical Representativeness, Time-related representativeness, Precision/uncertainty, and implementation of the End of Life Formula. The final scores for these 5 descriptors were determined by the independent, external reviewer after a discussion with the internal reviewers. The basis for this determination was generally a contribution analysis of the material and energy inputs as well as direct resource uses and emissions. This process was required by the tender. The contribution analysis is based on the most important flows in the dataset, defined in the tender specifications as \xe2\x80\x9cthe unit processes contributing cumulatively to at least to 80% of the total environmental impact based on characterised and normalised results\xe2\x80\x9d. In addition to unit processes, direct emissions also qualified as input exchanges for this approach. For the normalization, the normalisation factors \xe2\x80\x9cEC-JRC Global (2010 or 2013), per person\xe2\x80\x9d available at http://eplca.jrc.ec.europa.eu/?page_id=140 were used. For each parameter, the DQR scores were chosen to best reflect the conditions and quality of the amount value, the appropriateness of the chosen exchange for the specific needs of the system under analysis, and the quality of the foreground and background data for aggregated inputs of exchanges from the technosphere, i.e. not direct emissions or resource uses. ENERGY AND TRANSPORT INFORMATION SOURCE Energy and transport was used in both the foreground and background of this dataset. When building the dataset, energy and transport demands were supplied directly by datasets provided by thinkstep. The background for every other input from technosphere uses a modified version of the ecoinvent database, created specifically for the PEF. In this version, every instance of energy and transport supply, anywhere in the database, was replaced by a dataset from thinkstep. This ensures that every demand for energy and transport, in the foreground and in the background, is supplied by a thinkstep dataset. BILL OF MATERIALS The bill of material includes the following inputs: carbon monoxide: 0.481 kg chemical factory, organics: 4e-10 unit methanol: 0.505 kg nitrogen, liquid: 0.019 kg water, decarbonised, at user: 0.154 kg wastewater, unpolluted: -6.14e-05 m3 Electricity: 0.580562168821 kWh Thermal energy (MJ): 1.66929326541 MJ. NOT INCLUDED EXCHANGES The following exchanges have not been included in the inventory as they are not part of the official list of elementary exchanges published by the JRC. The EC and JRC were not able to provide an extended flow list during the duration of the data creation. If the JRC decides to include these exchanges in the master data, they may be added to the exchange section of the dataset by ecoinvent as part of a maintenance. The absence of these exchanges does not change the scores calculated with the ILCD recommended methods, but that might not be the case for other LCIA methods. Fatty acid methyl ester, Emissions to air, Emissions to air, unspecified: 4.16e-15 kg inland water bodies, Resources, Land occupation: 5.11e-05 m2*a sodium hydroxide, Emissions to water, Emissions to water, unspecified: 2.87e-14 kg sodium hypochlorite, Emissions to water, Emissions to water, unspecified: 5.35e-14 kg PROCESS DIAGRAM LEGEND The file 'chemical_dataset_diagram.jpg' presents the relationship between partially terminated datasets, energy and transport from datasets from thinkstep, and the aggregated inputs dataset. The aggregated inputs dataset is available on the node, under the name 'Acetic acid production, aggregated inputs, RER.xml' The following datasets from thinkstep are used as inputs of energy: 0.581 kWh of Electricity from Electricity grid mix 1kV-60kV - EU-28+3 0.252 MJ of Thermal energy (MJ) from Thermal energy from hard coal - EU-28+3 0.371 MJ of Thermal energy (MJ) from Thermal energy from light fuel oil (LFO) - EU-28+3 1.05 MJ of Thermal energy (MJ) from Thermal energy from natural gas - EU-28+3 The following datasets from thinkstep are used as inputs of transport: 0.00411 metric ton*km of Transport from Barge - EU-28+3 0.00832 metric ton*km of Transport from Barge - ROW w/o EU-28+3 0.0279 metric ton*km of Transport from Articulated lorry transport, Euro 3, Total weight >32 t (without fuel) - EU-28+3 0.00205 metric ton*km of Transport from Articulated lorry transport, Euro 3, Total weight 20-26 t (without fuel) - EU-28+3 0.0121 metric ton*km of Transport from Articulated lorry transport, Total weight 20-26 t, mix Euro 0-5 - ROW w/o EU-28+3 0.00904 metric ton*km of Transport from Articulated lorry transport, Total weight 14-20 t, mix Euro 0-5 - ROW w/o EU-28+3 0.00603 metric ton*km of Transport from Articulated lorry transport, Total weight 28-32 t, mix Euro 0-5 - ROW w/o EU-28+3 0.00102 metric ton*km of Transport from Articulated lorry transport, Euro 3, Total weight 28-32 t (without fuel) - EU-28+3 0.00166 metric ton*km of Transport from Articulated lorry transport, Euro 3, Total weight 14-20 t (without fuel) - EU-28+3 0.00156 metric ton*km of Transport from Articulated lorry transport, Euro 3, Total weight <7.5 t (without fuel) - EU-28+3 0.000128 metric ton*km of Transport from Articulated lorry transport, Euro 3, Total weight 12-14 t (without fuel) - EU-28+3 0.000287 metric ton*km of Transport from Articulated lorry transport, Euro 3, Total weight 7,5-12 t (without fuel) - EU-28+3 0.0258 metric ton*km of Transport from Articulated lorry transport, Euro 4, Total weight >32 t (without fuel) - EU-28+3 0.000844 metric ton*km of Transport from Articulated lorry transport, Euro 4, Total weight 20-26 t (without fuel) - EU-28+3 0.00136 metric ton*km of Transport from Articulated lorry transport, Euro 4, Total weight 12-14 t (without fuel) - EU-28+3 0.00178 metric ton*km of Transport from Articulated lorry transport, Euro 4, Total weight 14-20 t (without fuel) - EU-28+3 0.00102 metric ton*km of Transport from Articulated lorry transport, Euro 4, Total weight <7.5 t (without fuel) - EU-28+3 0.000203 metric ton*km of Transport from Articulated lorry transport, Euro 4, Total weight 7,5-12 t (without fuel) - EU-28+3 0.011 metric ton*km of Transport from Articulated lorry transport, Euro 5, Total weight >32 t (without fuel) - EU-28+3 0.000555 metric ton*km of Transport from Articulated lorry transport, Euro 5, Total weight 12-14 t (without fuel) - EU-28+3 0.000342 metric ton*km of Transport from Articulated lorry transport, Euro 5, Total weight 20-26 t (without fuel) - EU-28+3 0.000726 metric ton*km of Transport from Articulated lorry transport, Euro 5, Total weight 14-20 t (without fuel) - EU-28+3 0.000407 metric ton*km of Transport from Articulated lorry transport, Euro 5, Total weight <7.5 t (without fuel) - EU-28+3 9.57e-05 metric ton*km of Transport from Articulated lorry transport, Euro 5, Total weight 7,5-12 t (without fuel) - EU-28+3 0.302 metric ton*km of Transporting capacity from Transoceanic ship, containers - GLO 0.0762 metric ton*km of Transport from Freight train, diesel traction - EU-28+3 0.0772 metric ton*km of Transport from Freight train, electricity traction - EU-28+3 0.00331 metric ton*km of Transport from Freight train, average (without fuel) - EU-28+3
Copyright Yes
Owner of data set
Quantitative reference
Reference flow(s)
Time representativeness
Data set valid until 2020
Technological representativeness
Technology description including background system The process represents the Celanese process (which is an optimized version of the Monsanto process) in which methanol reacts with carbon monoxide under the influence of a rhodium catalyst. It is assumed that 50% of the off-gas is burned as fuel, thus VOC emissions are reduced and CO2 is higher.
LCI method and allocation
Type of data set LCI result
LCI Method Principle Attributional
Deviation from LCI method principle / explanations The background data use the \xe2\x80\x9cRecycled content cut-off\xe2\x80\x9d approach to allocate end-of-life by-products and secondary materials. This allocation is explained in the description of the recycled content system model (http://www.ecoinvent.org/database/system-models-in-ecoinvent-3/cut-off-system-model/allocation-cut-off-by-classification.html).
LCI method approaches
  • Allocation - market value
Deviations from LCI method approaches / explanations Allocation following the ISO 14044 hierarchy.
Modelling constants All modelling constants follow the requirements listed in the Tender Specifications ENV.B.1/SER/2016/0038vl. Completeness: All known environmental flows are included. All known resource uses and emissions are listed in the inventory. Water use: water use is modelled at country level using separate flows for water withdrawal, water release and water evaporation. Cut-off: All known environmental flows are included. All known resource uses and emissions are listed in the inventory. Handling multi-functional processes: the following PEF multi- functionality decision hierarchy is applied for resolving all multi- functionality problems: (1) subdivision or system expansion; (2) allocation based on a relevant underlying physical relationship (substitution may apply here); (3) allocation based on some other relationship. Direct land use change: GHG emissions from direct LUC allocated to good/service for 20 years after the LUC occurs, with IPCC default values. Carbon storage and delayed emissions: credits associated with temporary (carbon) storage or delayed emissions up to 300 years are not be considered. Emissions off-setting: are not included. Capital goods (including infrastructures) and their End of life: they are included. System boundaries: system boundaries include all processes linked to the product supply chain (e.g. maintenance). Time period: emissions and removals are modelled as if released or removed at the beginning of the assessment method. Fossil and biogenic carbon emissions and removals: removals and emissions are modelled as follows: All GHG emissions from fossil fuels (including peat and limestone) are modelled consistently with the most updated ILCD list of elementary flows. The non-fossil (biogenic) carbon flows are modelled consistently with the most updated ILCD list of elementary flows.
Deviation from modelling constants / explanations None
Data sources, treatment and representativeness
Data cut-off and completeness principles All known environmental flows are included. All known resource uses and emissions are listed in the inventory. The dataset dry mass balance has been checked to ensure the inventory is complete. Capital goods (e.g. infrastructure) and their end-of-life are included.
Deviation from data cut-off and completeness principles / explanations None
Data selection and combination principles These datasets include, in both their foreground and background data, links to energy and transport data provided specifically for the PEF pilot projects. The relevant background data on energy and transport are from the existing LCDN data node (http://lcdn.thinkstep.com/Node/). All other background data in the supply chain of this product are from the ecoinvent v3.3 database (www.ecoinvent.org).
Deviation from data selection and combination principles / explanations None
Data treatment and extrapolations principles Several data sources have been used to model the inventory.
Deviation from data treatment and extrapolations principles / explanations None
Uncertainty adjustments None
Completeness
Completeness of product model All relevant flows quantified
Validation
Type of review Data quality indicators
Independent review panel
  • Overall quality: Good - 2.0
  • Methodological appropriateness and consistency: Fair - 3.0
  • Precision: Good - 2.0
  • Geographical representativeness: Very good - 1.0
  • Time representativeness: Very good - 1.0
  • Technological representativeness: Good - 2.0
Type of review Scope / Method(s) of review Data quality indicators
Dependent internal review
Scope name Method name
LCI results or Partly terminated system
  • Validation of data sources
  • Element balance
  • Energy balance
  • Expert judgement
  • Cross-check with other data set
  • Cross-check with other source
  • Mass balance
  • Sample tests on calculations
  • Compliance with ISO 14040 to 14044
Life cycle inventory methods
  • Compliance with ISO 14040 to 14044
Unit process(es), black box
  • Validation of data sources
  • Element balance
  • Energy balance
  • Expert judgement
  • Cross-check with other data set
  • Cross-check with other source
  • Mass balance
  • Sample tests on calculations
  • Compliance with ISO 14040 to 14044
Raw data
  • Validation of data sources
  • Element balance
  • Energy balance
  • Expert judgement
  • Cross-check with other source
  • Documentation
  • Mass balance
  • Sample tests on calculations
Unit process(es), single operation
  • Validation of data sources
  • Element balance
  • Energy balance
  • Expert judgement
  • Cross-check with other data set
  • Cross-check with other source
  • Documentation
  • Mass balance
  • Sample tests on calculations
  • Compliance with ISO 14040 to 14044
LCIA results
  • Cross-check with other data set
  • Cross-check with other source
  • Expert judgement
Documentation
  • Expert judgement
  • Compliance with ISO 14040 to 14044
  • Overall quality: Good - 2.0
  • Methodological appropriateness and consistency: Fair - 3.0
  • Precision: Good - 2.0
  • Geographical representativeness: Very good - 1.0
  • Time representativeness: Very good - 1.0
  • Technological representativeness: Good - 2.0
Complete review report
Compliance Declarations
Compliance
Compliance system name
Approval of overall compliance
Fully compliant
Nomenclature compliance
Fully compliant
Methodological compliance
Fully compliant
Review compliance
Fully compliant
Documentation compliance
Fully compliant
Quality compliance
Fully compliant
Compliance
Compliance system name
Approval of overall compliance
Fully compliant
Nomenclature compliance
Not defined
Methodological compliance
Fully compliant
Review compliance
Fully compliant
Documentation compliance
Not defined
Quality compliance
Fully compliant
Commissioner and goal
Commissioner of data set
Project Provision of chemicals process-based product environmental footprint-compliant life cycle inventory datasets. Contract number ENV.A.1/SER/2016/0038vl
Intended applications This dataset is to be used only within the pilot projects of the PEF/OEF. The dataset and background data contain modeling choices and data sources that are not generally recommended for use in LCAs beyond the PEF/OEF pilot projects.
Data generator
Data set generator / modeller
Data entry by
Time stamp (last saved) 2017-05-13T02:00:00+01:00
Data set format(s)
Data entry by
Publication and ownership
UUID 09c336e4-436b-4be0-95bd-444d2295dc0d
Date of last revision 2017-05-13T02:00:00+01:00
Data set version 03.00.008
Owner of data set
Copyright Yes
Reference to entities with exclusive access
License type Free of charge for some user types or use types
Access and use restrictions Free of charge for all final users implementing the data in one of the 24 PEFCRs/OEFSRs developed during the Environmental Footprint pilot phase. The final users using this dataset must agree with and submit to the ecoinvent End User License Agreement - EULA \'ecoinvent Production of Chemicals datasets created for the EU Product Environmental Footprint (PEF) implementation 2016 - 2020\' of ecoinvent (www.ecoinvent.org). Any use of this dataset or any derivative data not within the specific context of one of the PEF/OEF pilot projects or after the end of 2020 is not permitted.
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