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Mucochloric Acid

UUID 5fda55eb-d6b2-4614-9ea6-381df190ee0f
Flow Object IDfo-ffeeea9abe49f1fd
Source EF 3.1
Context Environmental → Air → Ground level → Urban (>1000 people/square mile)
CAS Numbers 87-56-9
EC Numbers 201-752-4
prefLabel
Language Value Provenance
en Mucochloric Acid
altLabel ⓘ
Language Value Provenance
en (2<em>Z</em>)-2,3-Dichloro-4-oxo-2-butenoic acid
en 2,3-Dichloromaleic aldehyde acid
en 2-Butenoic acid, 2,3-dichloro-4-oxo-, (2<em>Z</em>)-
en 2-Butenoic acid, 2,3-dichloro-4-oxo-, (<em>Z</em>)-
en Dichloromalealdehydic acid
en Malealdehydic acid, dichloro-
en α,β-Dichloro-β-formylacrylic acid
References
Shared Properties
Predicate Value
InChIKey LUMLZKVIXLWTCI-IHWYPQMZSA-N, LUMLZKVIXLWTCI-NSCUHMNNSA-N, LUMLZKVIXLWTCI-UHFFFAOYSA-N, MHNLCWVXJRORCJ-SPNQZIMRSA-N, TUXFWOHFPFBNEJ-GJGHEGAFSA-N, ZAKLKBFCSHJIRI-UHFFFAOYSA-N
InChI InChI=1S/C20H30O4/c1-2-3-6-10-17(21)13-14-18-16(12-15-19(18)22)9-7-4-5-8-11-20(23)24/h4,7,12,14-17,21H,2-3,5-6,8-11,13H2,1H3,(H,23,24)/b7-4-,18-14+/t16-,17-/m0/s1, InChI=1S/C3H2Cl2O.CH2O2/c4-1-3(5)2-6;2-1-3/h1-2H;1H,(H,2,3)/b3-1-;, InChI=1S/C4H2Cl2O3/c5-1-2(6)4(8)9-3(1)7/h3,7H, InChI=1S/C4H2Cl2O3/c5-2(1-7)3(6)4(8)9/h1H,(H,8,9), InChI=1S/C4H2Cl2O3/c5-2(1-7)3(6)4(8)9/h1H,(H,8,9)/b3-2+, InChI=1S/C4H2Cl2O3/c5-2(1-7)3(6)4(8)9/h1H,(H,8,9)/b3-2-
IUPAC name (E)-2,3-bis(chloranyl)-4-oxidanylidene-but-2-enoic acid, (E)-2,3-dichloro-4-keto-but-2-enoic acid, (E)-2,3-dichloro-4-oxo-2-butenoic acid, (E)-2,3-dichloro-4-oxo-but-2-enoic acid, (E)-2,3-dichloro-4-oxobut-2-enoic acid, (Z)-2,3-bis(chloranyl)-4-oxidanylidene-but-2-enoic acid, (Z)-2,3-bis(chloranyl)prop-2-enal;methanoic acid, (Z)-2,3-dichloro-2-propenal;formic acid, (Z)-2,3-dichloro-4-keto-but-2-enoic acid, (Z)-2,3-dichloro-4-oxo-2-butenoic acid, (Z)-2,3-dichloro-4-oxo-but-2-enoic acid, (Z)-2,3-dichloro-4-oxobut-2-enoic acid, (Z)-2,3-dichloroacrolein;formic acid, (Z)-2,3-dichloroprop-2-enal;formic acid, (Z)-7-[(1S,5E)-4-oxidanylidene-5-[(3S)-3-oxidanyloctylidene]cyclopent-2-en-1-yl]hept-5-enoic acid, (Z)-7-[(1S,5E)-5-[(3S)-3-hydroxyoctylidene]-4-keto-cyclopent-2-en-1-yl]hept-5-enoic acid, (Z)-7-[(1S,5E)-5-[(3S)-3-hydroxyoctylidene]-4-oxo-1-cyclopent-2-enyl]-5-heptenoic acid, (Z)-7-[(1S,5E)-5-[(3S)-3-hydroxyoctylidene]-4-oxo-cyclopent-2-en-1-yl]hept-5-enoic acid, (Z)-7-[(1S,5E)-5-[(3S)-3-hydroxyoctylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoic acid, 2,3-bis(chloranyl)-4-oxidanylidene-but-2-enoic acid, 2,3-dichloro-4-keto-but-2-enoic acid, 2,3-dichloro-4-oxo-2-butenoic acid, 2,3-dichloro-4-oxo-but-2-enoic acid, 2,3-dichloro-4-oxobut-2-enoic acid, 3,4-bis(chloranyl)-2-oxidanyl-2H-furan-5-one, 3,4-dichloro-2-hydroxy-2H-furan-5-one
Molecular formula C20H30O4, C4H2Cl2O3, C4H4Cl2O3
SMILES C(=C(/C=O)\Cl)\Cl.C(=O)O, C(=C(C=O)Cl)Cl.C(=O)O, C(=O)/C(=C(/C(=O)O)\Cl)/Cl, C(=O)/C(=C(\C(=O)O)/Cl)/Cl, C(=O)C(=C(C(=O)O)Cl)Cl, C1(C(=C(C(=O)O1)Cl)Cl)O, CCCCCC(CC=C1C(C=CC1=O)CC=CCCCC(=O)O)O, CCCCC[C@@H](C/C=C/1\[C@H](C=CC1=O)C/C=C\CCCC(=O)O)O

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 5fda55eb-d6b2-4614-9ea6-381df190ee0f mucochloric acid

Concept Associations

Source List Source Flow Source Context Unit Match Type Conversion Provenance
EF 3.1 mucochloric acid 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=mucochloricacid||dimension=Environmental > media=Air > strata=High stack, >150 meters; cas=87-56-9; added Common Chemistry CAS names as altLabel: (2<em>Z</em>)-2,3-Dichloro-4-oxo-2-butenoic acid, 2,3-Dichloromaleic aldehyde acid, 2-Butenoic acid, 2,3-dichloro-4-oxo-, (2<em>Z</em>)-, 2-Butenoic acid, 2,3-dichloro-4-oxo-, (<em>Z</em>)-, Dichloromalealdehydic acid, Malealdehydic acid, dichloro-, α,β-Dichloro-β-formylacrylic acid; object_uuid=fo-ffeeea9abe49f1fd
cas_match_labels 1 — consensus_match group_key=mucochloricacid||dimension=Environmental > media=Air > strata=High stack, >150 meters; group_sources=['ec_inventory', 'pubchem']; cas_sources={'87-56-9': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-ffeeea9abe49f1fd: {'87-56-9': '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': '(2<em>Z</em>)-2,3-Dichloro-4-oxo-2-butenoic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:87-56-9', 'https://commonchemistry.cas.org/detail?cas_rn=87-56-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '2,3-Dichloromaleic aldehyde acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:87-56-9', 'https://commonchemistry.cas.org/detail?cas_rn=87-56-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '2-Butenoic acid, 2,3-dichloro-4-oxo-, (2<em>Z</em>)-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:87-56-9', 'https://commonchemistry.cas.org/detail?cas_rn=87-56-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '2-Butenoic acid, 2,3-dichloro-4-oxo-, (<em>Z</em>)-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:87-56-9', 'https://commonchemistry.cas.org/detail?cas_rn=87-56-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Dichloromalealdehydic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:87-56-9', 'https://commonchemistry.cas.org/detail?cas_rn=87-56-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Malealdehydic acid, dichloro-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:87-56-9', 'https://commonchemistry.cas.org/detail?cas_rn=87-56-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'α,β-Dichloro-β-formylacrylic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:87-56-9', 'https://commonchemistry.cas.org/detail?cas_rn=87-56-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=mucochloricacid||dimension=Environmental > media=Air > strata=High stack, >150 meters; cas=87-56-9; added Common Chemistry CAS names as altLabel: (2<em>Z</em>)-2,3-Dichloro-4-oxo-2-butenoic acid, 2,3-Dichloromaleic aldehyde acid, 2-Butenoic acid, 2,3-dichloro-4-oxo-, (2<em>Z</em>)-, 2-Butenoic acid, 2,3-dichloro-4-oxo-, (<em>Z</em>)-, Dichloromalealdehydic acid, Malealdehydic acid, dichloro-, α,β-Dichloro-β-formylacrylic acid; object_uuid=fo-ffeeea9abe49f1fd
cas_match_labels None {'87-56-9': 'exactMatch'} group_key=mucochloricacid||dimension=Environmental > media=Air > strata=High stack, >150 meters; group_sources=['ec_inventory', 'pubchem']; cas_sources={'87-56-9': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-ffeeea9abe49f1fd: {'87-56-9': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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    "strata": "Ground level",
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  "unit": "kg",
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      "methodology": "Environmental Footprint",
      "impact_category": "Aquatic eco-toxicity",
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      "characterization_factor": 64.366
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      "name": "Ecotoxicity, freshwater_organics",
      "methodology": "Environmental Footprint",
      "impact_category": "Aquatic eco-toxicity",
      "impact_indicator": "Comparative Toxic Unit for ecosystems (CTUe) ",
      "characterization_factor": 64.366
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  "source": "EF 3.1",
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        "(E)-2,3-bis(chloranyl)-4-oxidanylidene-but-2-enoic acid",
        "(E)-2,3-dichloro-4-keto-but-2-enoic acid",
        "(E)-2,3-dichloro-4-oxo-2-butenoic acid",
        "(E)-2,3-dichloro-4-oxo-but-2-enoic acid",
        "(E)-2,3-dichloro-4-oxobut-2-enoic acid",
        "(Z)-2,3-bis(chloranyl)-4-oxidanylidene-but-2-enoic acid",
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        "(Z)-2,3-dichloro-4-keto-but-2-enoic acid",
        "(Z)-2,3-dichloro-4-oxo-2-butenoic acid",
        "(Z)-2,3-dichloro-4-oxo-but-2-enoic acid",
        "(Z)-2,3-dichloro-4-oxobut-2-enoic acid",
        "(Z)-2,3-dichloroacrolein;formic acid",
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        "(Z)-7-[(1S,5E)-4-oxidanylidene-5-[(3S)-3-oxidanyloctylidene]cyclopent-2-en-1-yl]hept-5-enoic acid",
        "(Z)-7-[(1S,5E)-5-[(3S)-3-hydroxyoctylidene]-4-keto-cyclopent-2-en-1-yl]hept-5-enoic acid",
        "(Z)-7-[(1S,5E)-5-[(3S)-3-hydroxyoctylidene]-4-oxo-1-cyclopent-2-enyl]-5-heptenoic acid",
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        "(Z)-7-[(1S,5E)-5-[(3S)-3-hydroxyoctylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoic acid",
        "2,3-bis(chloranyl)-4-oxidanylidene-but-2-enoic acid",
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