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Calcium Diethyl Bis[[[3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl]methyl]phosphonate]

UUID 76e9f683-407c-42dd-bd8b-582531a4151e
Flow Object IDfo-d1de65d014e93ffc
Source EF 3.1
Context Environmental → Air → Ground level → Urban (>1000 people/square mile)
CAS Numbers 65140-91-2
EC Numbers 265-512-0
prefLabel
Language Value Provenance
en Calcium Diethyl Bis[[[3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl]methyl]phosphonate]
altLabel ⓘ
Language Value Provenance
en 3,5-Di-<em>tert</em>-butyl-4-hydroxybenzylphosphonic acid, monoethyl ester, calcium salt
en Antioxidant 1425
en BNX 1425
en Calcium (3,5-di-<em>tert</em>-butyl-4-hydroxybenzyl monoethyl phosphonate)
en Calcium bis(ethyl 3,5-di-<em>tert</em>-butyl-4-hydroxybenzylphosphonate)
en Calcium bis(ethyl 3,5-di-tert-butyl-4-hydroxybenzylphosphonate)
en Calcium bis(monoethyl (3,5-di-tert-butyl-4-hydroxylbenzyl)phosphonate)
en Calcium bis[3,5-di(<em>tert</em>-butyl)-4-hydroxybenzyl(ethoxy)phosphinate]
en Calcium bis[ethyl (3,5-di-<em>tert</em>-butyl-4-hydroxyphenyl)methanephosphonate]
en Calcium bis[monoethyl (3,5-di-<em>tert</em>-butyl-4-hydroxybenzyl)phosphonate]
en Calcium diethyl bis[[[3,5-(1,1-dimethylethyl)-4-hydroxyphenyl]methyl]phosphonate]
en Ciba 195
en IR 1425WL
en Irgamod 195
en Irganox 1425
en Irganox 1425WL
en Irganox I 1425
en Phosphonic acid, <em>P</em>-[[3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl]methyl]-, monoethyl ester, calcium salt (2:1)
en Phosphonic acid, [[3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl]methyl]-, monoethyl ester, calcium salt (2:1)
References
Shared Properties
Predicate Value
InChIKey DYHSBBDFFBVQSS-UHFFFAOYSA-J, FIRJKSXFLZVPBN-UHFFFAOYSA-L, NJPKNCYCYLYTDP-UHFFFAOYSA-N, OOCILPYOPQKPJY-UHFFFAOYSA-N, QBMVLWIYHYZWSI-STQMWFEESA-N, SJEZDMHBMZPMME-UHFFFAOYSA-L, WBSRIXCTCFFHEF-UHFFFAOYSA-N
InChI InChI=1S/2C17H29O3P.Ca/c2*1-8-20-21(18,19)12-13-9-14(16(2,3)4)11-15(10-13)17(5,6)7;/h2*9-11H,8,12H2,1-7H3,(H,18,19);/q;;+2/p-2, InChI=1S/2C17H29O4P.2Ca/c2*1-8-14(22(19,20)21)11-9-12(16(2,3)4)15(18)13(10-11)17(5,6)7;;/h2*9-10,14,18H,8H2,1-7H3,(H2,19,20,21);;/q;;2*+2/p-4, InChI=1S/2C17H29O4P.Ca/c2*1-8-21-22(19,20)11-12-9-13(16(2,3)4)15(18)14(10-12)17(5,6)7;/h2*9-10,18H,8,11H2,1-7H3,(H,19,20);, InChI=1S/2C17H29O4P.Ca/c2*1-8-21-22(19,20)11-12-9-13(16(2,3)4)15(18)14(10-12)17(5,6)7;/h2*9-10,18H,8,11H2,1-7H3,(H,19,20);/q;;+2/p-2, InChI=1S/C17H29O4P.Ca/c1-8-21-22(19,20)11-12-9-13(16(2,3)4)15(18)14(10-12)17(5,6)7;/h9-10,18H,8,11H2,1-7H3,(H,19,20);, InChI=1S/C17H29O4P/c1-8-21-22(19,20)11-12-9-13(16(2,3)4)15(18)14(10-12)17(5,6)7/h9-10,18H,8,11H2,1-7H3,(H,19,20), InChI=1S/C18H29N3O6/c1-18(2,3)27-17(26)21-11-5-7-13(21)16(25)20-10-4-6-12(20)15(24)19-9-8-14(22)23/h12-13H,4-11H2,1-3H3,(H,19,24)(H,22,23)/t12-,13-/m0/s1
IUPAC name (3,5-ditert-butyl-4-hydroxy-benzyl)-ethoxy-phosphinic acid, (3,5-ditert-butyl-4-hydroxy-phenyl)methyl-ethoxy-phosphinic acid, (3,5-ditert-butyl-4-hydroxyphenyl)methyl-ethoxyphosphinic acid, (3,5-ditert-butyl-4-oxidanyl-phenyl)methyl-ethoxy-phosphinic acid, 3-[[(2S)-1-[(2S)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-2-yl]carbonylpyrrolidin-2-yl]carbonylamino]propanoic acid, 3-[[(2S)-1-[(2S)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carbonyl]amino]propanoic acid, 3-[[(2S)-1-[(2S)-1-tert-butoxycarbonylprolyl]prolyl]amino]propionic acid, 3-[[(2S)-1-[(2S)-1-tert-butoxycarbonylpyrrolidine-2-carbonyl]pyrrolidine-2-carbonyl]amino]propanoic acid, 3-[[[(2S)-1-[[(2S)-1-[(2-methylpropan-2-yl)oxy-oxomethyl]-2-pyrrolidinyl]-oxomethyl]-2-pyrrolidinyl]-oxomethyl]amino]propanoic acid, calcium bis((3,5-ditert-butyl-4-hydroxy-benzyl)-ethoxy-phosphinate), calcium bis((3,5-ditert-butyl-4-hydroxy-phenyl)methyl-ethoxy-phosphinate), calcium bis((3,5-ditert-butyl-4-hydroxyphenyl)methyl-ethoxyphosphinate), calcium bis((3,5-ditert-butyl-4-oxidanyl-phenyl)methyl-ethoxy-phosphinate), calcium bis((3,5-ditert-butylbenzyl)-ethoxy-phosphinate), calcium bis((3,5-ditert-butylphenyl)methyl-ethoxy-phosphinate), calcium bis((3,5-ditert-butylphenyl)methyl-ethoxyphosphinate), calcium;(3,5-ditert-butyl-4-hydroxy-benzyl)-ethoxy-phosphinic acid;(3,5-ditert-butyl-4-oxido-benzyl)-ethoxy-phosphinate, calcium;(3,5-ditert-butyl-4-hydroxy-phenyl)methyl-ethoxy-phosphinic acid;(3,5-ditert-butyl-4-oxido-phenyl)methyl-ethoxy-phosphinate, calcium;(3,5-ditert-butyl-4-hydroxyphenyl)methyl-ethoxyphosphinic acid;(3,5-ditert-butyl-4-oxidophenyl)methyl-ethoxyphosphinate, calcium;(3,5-ditert-butyl-4-oxidanidyl-phenyl)methyl-ethoxy-phosphinate;(3,5-ditert-butyl-4-oxidanyl-phenyl)methyl-ethoxy-phosphinic acid, dicalcium bis(2,6-ditert-butyl-4-(1-phosphonatopropyl)phenol)
Molecular formula C17H29CaO4P, C17H29O4P, C18H29N3O6, C34H54Ca2O8P2, C34H56CaO6P2, C34H56CaO8P2, C34H58CaO8P2
SMILES CC(C)(C)OC(=O)N1CCCC1C(=O)N2CCCC2C(=O)NCCC(=O)O, CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)N2CCC[C@H]2C(=O)NCCC(=O)O, CCC(C1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C)P(=O)([O-])[O-].CCC(C1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C)P(=O)([O-])[O-].[Ca+2].[Ca+2], CCOP(=O)(CC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C)O, CCOP(=O)(CC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C)O.CCOP(=O)(CC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C)O.[Ca], CCOP(=O)(CC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C)O.CCOP(=O)(CC1=CC(=C(C(=C1)C(C)(C)C)[O-])C(C)(C)C)[O-].[Ca+2], CCOP(=O)(CC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C)O.[Ca], CCOP(=O)(CC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C)[O-].CCOP(=O)(CC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C)[O-].[Ca+2], CCOP(=O)(CC1=CC(=CC(=C1)C(C)(C)C)C(C)(C)C)[O-].CCOP(=O)(CC1=CC(=CC(=C1)C(C)(C)C)C(C)(C)C)[O-].[Ca+2]

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 76e9f683-407c-42dd-bd8b-582531a4151e calcium diethyl bis[[[3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl]methyl]phosphonate]

Concept Associations

Source List Source Flow Source Context Unit Match Type Conversion Provenance
EF 3.1 calcium diethyl bis[[[3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl]methyl]phosphonate] Emissions/Emissions to air/Emissions to urban air close to ground kg exactMatch —

Consolidated Field Provenance

0 total PROV activity record(s) for this flow.

Field Change Count Latest Time Transformers Latest Comment
altLabel 1 — consensus_match group_key=calciumdiethylbis[[[3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl]methyl]phosphonate]||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); cas=65140-91-2; added Common Chemistry CAS names as altLabel: 3,5-Di-<em>tert</em>-butyl-4-hydroxybenzylphosphonic acid, monoethyl ester, calcium salt, Antioxidant 1425, BNX 1425, Calcium (3,5-di-<em>tert</em>-butyl-4-hydroxybenzyl monoethyl phosphonate), Calcium bis(ethyl 3,5-di-<em>tert</em>-butyl-4-hydroxybenzylphosphonate), Calcium bis(ethyl 3,5-di-tert-butyl-4-hydroxybenzylphosphonate), Calcium bis(monoethyl (3,5-di-tert-butyl-4-hydroxylbenzyl)phosphonate), Calcium bis[3,5-di(<em>tert</em>-butyl)-4-hydroxybenzyl(ethoxy)phosphinate], Calcium bis[ethyl (3,5-di-<em>tert</em>-butyl-4-hydroxyphenyl)methanephosphonate], Calcium bis[monoethyl (3,5-di-<em>tert</em>-butyl-4-hydroxybenzyl)phosphonate], Calcium diethyl bis[[[3,5-(1,1-dimethylethyl)-4-hydroxyphenyl]methyl]phosphonate], Ciba 195, IR 1425WL, Irgamod 195, Irganox 1425, Irganox 1425WL, Irganox I 1425, Phosphonic acid, <em>P</em>-[[3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl]methyl]-, monoethyl ester, calcium salt (2:1), Phosphonic acid, [[3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl]methyl]-, monoethyl ester, calcium salt (2:1); object_uuid=fo-d1de65d014e93ffc
cas_match_labels 1 — consensus_match group_key=calciumdiethylbis[[[3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl]methyl]phosphonate]||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'65140-91-2': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-d1de65d014e93ffc: {'65140-91-2': 'exactMatch'}

Context Attributes

AttributeValue
dimensionEnvironmental
mediaAir
strataGround level
population_densityUrban (>1000 people/square mile)

Consensus Changes

Field Old Value New Value Comment
altLabel None [{'@value': '3,5-Di-<em>tert</em>-butyl-4-hydroxybenzylphosphonic acid, monoethyl ester, calcium salt', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:65140-91-2', 'https://commonchemistry.cas.org/detail?cas_rn=65140-91-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Antioxidant 1425', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:65140-91-2', 'https://commonchemistry.cas.org/detail?cas_rn=65140-91-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'BNX 1425', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:65140-91-2', 'https://commonchemistry.cas.org/detail?cas_rn=65140-91-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Calcium (3,5-di-<em>tert</em>-butyl-4-hydroxybenzyl monoethyl phosphonate)', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:65140-91-2', 'https://commonchemistry.cas.org/detail?cas_rn=65140-91-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Calcium bis(ethyl 3,5-di-<em>tert</em>-butyl-4-hydroxybenzylphosphonate)', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:65140-91-2', 'https://commonchemistry.cas.org/detail?cas_rn=65140-91-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Calcium bis(ethyl 3,5-di-tert-butyl-4-hydroxybenzylphosphonate)', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:65140-91-2', 'https://commonchemistry.cas.org/detail?cas_rn=65140-91-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Calcium bis(monoethyl (3,5-di-tert-butyl-4-hydroxylbenzyl)phosphonate)', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:65140-91-2', 'https://commonchemistry.cas.org/detail?cas_rn=65140-91-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Calcium bis[3,5-di(<em>tert</em>-butyl)-4-hydroxybenzyl(ethoxy)phosphinate]', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:65140-91-2', 'https://commonchemistry.cas.org/detail?cas_rn=65140-91-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Calcium bis[ethyl (3,5-di-<em>tert</em>-butyl-4-hydroxyphenyl)methanephosphonate]', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:65140-91-2', 'https://commonchemistry.cas.org/detail?cas_rn=65140-91-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Calcium bis[monoethyl (3,5-di-<em>tert</em>-butyl-4-hydroxybenzyl)phosphonate]', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:65140-91-2', 'https://commonchemistry.cas.org/detail?cas_rn=65140-91-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Calcium diethyl bis[[[3,5-(1,1-dimethylethyl)-4-hydroxyphenyl]methyl]phosphonate]', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:65140-91-2', 'https://commonchemistry.cas.org/detail?cas_rn=65140-91-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Ciba 195', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:65140-91-2', 'https://commonchemistry.cas.org/detail?cas_rn=65140-91-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'IR 1425WL', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:65140-91-2', 'https://commonchemistry.cas.org/detail?cas_rn=65140-91-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Irgamod 195', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:65140-91-2', 'https://commonchemistry.cas.org/detail?cas_rn=65140-91-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Irganox 1425', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:65140-91-2', 'https://commonchemistry.cas.org/detail?cas_rn=65140-91-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Irganox 1425WL', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:65140-91-2', 'https://commonchemistry.cas.org/detail?cas_rn=65140-91-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Irganox I 1425', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:65140-91-2', 'https://commonchemistry.cas.org/detail?cas_rn=65140-91-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Phosphonic acid, <em>P</em>-[[3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl]methyl]-, monoethyl ester, calcium salt (2:1)', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:65140-91-2', 'https://commonchemistry.cas.org/detail?cas_rn=65140-91-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Phosphonic acid, [[3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl]methyl]-, monoethyl ester, calcium salt (2:1)', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:65140-91-2', 'https://commonchemistry.cas.org/detail?cas_rn=65140-91-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=calciumdiethylbis[[[3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl]methyl]phosphonate]||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); cas=65140-91-2; added Common Chemistry CAS names as altLabel: 3,5-Di-<em>tert</em>-butyl-4-hydroxybenzylphosphonic acid, monoethyl ester, calcium salt, Antioxidant 1425, BNX 1425, Calcium (3,5-di-<em>tert</em>-butyl-4-hydroxybenzyl monoethyl phosphonate), Calcium bis(ethyl 3,5-di-<em>tert</em>-butyl-4-hydroxybenzylphosphonate), Calcium bis(ethyl 3,5-di-tert-butyl-4-hydroxybenzylphosphonate), Calcium bis(monoethyl (3,5-di-tert-butyl-4-hydroxylbenzyl)phosphonate), Calcium bis[3,5-di(<em>tert</em>-butyl)-4-hydroxybenzyl(ethoxy)phosphinate], Calcium bis[ethyl (3,5-di-<em>tert</em>-butyl-4-hydroxyphenyl)methanephosphonate], Calcium bis[monoethyl (3,5-di-<em>tert</em>-butyl-4-hydroxybenzyl)phosphonate], Calcium diethyl bis[[[3,5-(1,1-dimethylethyl)-4-hydroxyphenyl]methyl]phosphonate], Ciba 195, IR 1425WL, Irgamod 195, Irganox 1425, Irganox 1425WL, Irganox I 1425, Phosphonic acid, <em>P</em>-[[3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl]methyl]-, monoethyl ester, calcium salt (2:1), Phosphonic acid, [[3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl]methyl]-, monoethyl ester, calcium salt (2:1); object_uuid=fo-d1de65d014e93ffc
cas_match_labels None {'65140-91-2': 'exactMatch'} group_key=calciumdiethylbis[[[3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl]methyl]phosphonate]||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'65140-91-2': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-d1de65d014e93ffc: {'65140-91-2': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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  "name": null,
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  "general_comment": null,
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  "unit": "kg",
  "lcia_methods": [
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      "impact_indicator": "Comparative Toxic Unit for human (CTUh)",
      "characterization_factor": 4.4063e-7
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      "characterization_factor": 4.4063e-7
    },
    {
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