4-butoxy-4-oxobut-2-enoic Acid

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4-butoxy-4-oxobut-2-enoic Acid

UUID b19457e5-ed99-4c28-928b-c8531e37da6a

Flow Object ID fo-08d9631c493b6b97

Source EF 3.1

Context Environmental → Ground → Agricultural

CAS Numbers 925-21-3

EC Numbers 213-116-3

prefLabel

Language	Value	Provenance
`en`	`4-butoxy-4-oxobut-2-enoic Acid`

altLabel ⓘ

Language	Value	Provenance
`en`	`2-Butenedioic acid (2<em>Z</em>)-, 1-butyl ester`
`en`	`2-Butenedioic acid (2<em>Z</em>)-, monobutyl ester`
`en`	`2-Butenedioic acid (<em>Z</em>)-, monobutyl ester`
`en`	`Butyl hydrogen maleate`
`en`	`Hydrogen butyl maleate`
`en`	`Maleic acid monombutyl ester`
`en`	`Maleic acid, butyl ester`
`en`	`Maleic acid, monobutyl ester`
`en`	`Monobutyl maleate`

References

Shared Properties

Predicate	Value
InChIKey	`RKEQOAJSERQNES-UHFFFAOYSA-N, UTOVMEACOLCUCK-PLNGDYQASA-M, UTOVMEACOLCUCK-PLNGDYQASA-N, UTOVMEACOLCUCK-SNAWJCMRSA-N, UTOVMEACOLCUCK-UHFFFAOYSA-M, UTOVMEACOLCUCK-UHFFFAOYSA-N`
InChI	`InChI=1S/C5H10O2.C3H4O2/c1-2-3-4-7-5-6;1-2-3(4)5/h5H,2-4H2,1H3;2H,1H2,(H,4,5), InChI=1S/C8H12O4/c1-2-3-6-12-8(11)5-4-7(9)10/h4-5H,2-3,6H2,1H3,(H,9,10), InChI=1S/C8H12O4/c1-2-3-6-12-8(11)5-4-7(9)10/h4-5H,2-3,6H2,1H3,(H,9,10)/b5-4+, InChI=1S/C8H12O4/c1-2-3-6-12-8(11)5-4-7(9)10/h4-5H,2-3,6H2,1H3,(H,9,10)/b5-4-, InChI=1S/C8H12O4/c1-2-3-6-12-8(11)5-4-7(9)10/h4-5H,2-3,6H2,1H3,(H,9,10)/p-1, InChI=1S/C8H12O4/c1-2-3-6-12-8(11)5-4-7(9)10/h4-5H,2-3,6H2,1H3,(H,9,10)/p-1/b5-4-`
IUPAC name	(E)-4-butoxy-4-keto-but-2-enoic acid, (E)-4-butoxy-4-oxidanylidene-but-2-enoic acid, (E)-4-butoxy-4-oxo-2-butenoic acid, (E)-4-butoxy-4-oxo-but-2-enoic acid, (E)-4-butoxy-4-oxobut-2-enoic acid, (Z)-4-butoxy-4-keto-but-2-enoate, (Z)-4-butoxy-4-keto-but-2-enoic acid, (Z)-4-butoxy-4-oxidanylidene-but-2-enoate, (Z)-4-butoxy-4-oxidanylidene-but-2-enoic acid, (Z)-4-butoxy-4-oxo-2-butenoate, (Z)-4-butoxy-4-oxo-2-butenoic acid, (Z)-4-butoxy-4-oxo-but-2-enoate, (Z)-4-butoxy-4-oxo-but-2-enoic acid, (Z)-4-butoxy-4-oxobut-2-enoate, (Z)-4-butoxy-4-oxobut-2-enoic acid, 4-butoxy-4-keto-but-2-enoate, 4-butoxy-4-keto-but-2-enoic acid, 4-butoxy-4-oxidanylidene-but-2-enoate, 4-butoxy-4-oxidanylidene-but-2-enoic acid, 4-butoxy-4-oxo-2-butenoate, 4-butoxy-4-oxo-2-butenoic acid, 4-butoxy-4-oxo-but-2-enoate, 4-butoxy-4-oxo-but-2-enoic acid, 4-butoxy-4-oxobut-2-enoate, 4-butoxy-4-oxobut-2-enoic acid, acrylic acid;butyl formate, acrylic acid;formic acid butyl ester, butyl formate;prop-2-enoic acid, butyl methanoate;prop-2-enoic acid, formic acid butyl ester;2-propenoic acid
Molecular formula	`C8H11O4-, C8H12O4, C8H14O4`
SMILES	`CCCCOC(=O)/C=C/C(=O)O, CCCCOC(=O)/C=C\C(=O)O, CCCCOC(=O)/C=C\C(=O)[O-], CCCCOC(=O)C=CC(=O)O, CCCCOC(=O)C=CC(=O)[O-], CCCCOC=O.C=CC(=O)O`

Source List References

List	Version	Source Flow UUID	Source Flow Name
EF	3.1	`b19457e5-ed99-4c28-928b-c8531e37da6a`	4-butoxy-4-oxobut-2-enoic acid

Concept Associations

Source List	Source Flow	Source Context	Unit	Match Type	Conversion	Provenance
EF 3.1	4-butoxy-4-oxobut-2-enoic acid	Emissions/Emissions to soil/Emissions to agricultural soil	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=4-butoxy-4-oxobut-2-enoicacid\|\|dimension=Environmental > media=Ground > geography=Unknown; cas=925-21-3; added Common Chemistry CAS names as altLabel: 2-Butenedioic acid (2<em>Z</em>)-, 1-butyl ester, 2-Butenedioic acid (2<em>Z</em>)-, monobutyl ester, 2-Butenedioic acid (<em>Z</em>)-, monobutyl ester, Butyl hydrogen maleate, Hydrogen butyl maleate, Maleic acid monombutyl ester, Maleic acid, butyl ester, Maleic acid, monobutyl ester, Monobutyl maleate; object_uuid=fo-08d9631c493b6b97
`cas_match_labels`	1	`—`	consensus_match	group_key=4-butoxy-4-oxobut-2-enoicacid\|\|dimension=Environmental > media=Ground > geography=Unknown; group_sources=['ec_inventory']; cas_sources={'925-21-3': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-08d9631c493b6b97: {'925-21-3': 'exactMatch'}

Context Attributes

Attribute	Value
dimension	Environmental
media	Ground
geography	Agricultural

Consensus Changes

Field	Old Value	New Value	Comment
`altLabel`	`None`	[{'@value': '2-Butenedioic acid (2<em>Z</em>)-, 1-butyl ester', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:925-21-3', 'https://commonchemistry.cas.org/detail?cas_rn=925-21-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '2-Butenedioic acid (2<em>Z</em>)-, monobutyl ester', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:925-21-3', 'https://commonchemistry.cas.org/detail?cas_rn=925-21-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '2-Butenedioic acid (<em>Z</em>)-, monobutyl ester', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:925-21-3', 'https://commonchemistry.cas.org/detail?cas_rn=925-21-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Butyl hydrogen maleate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:925-21-3', 'https://commonchemistry.cas.org/detail?cas_rn=925-21-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Hydrogen butyl maleate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:925-21-3', 'https://commonchemistry.cas.org/detail?cas_rn=925-21-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Maleic acid monombutyl ester', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:925-21-3', 'https://commonchemistry.cas.org/detail?cas_rn=925-21-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Maleic acid, butyl ester', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:925-21-3', 'https://commonchemistry.cas.org/detail?cas_rn=925-21-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Maleic acid, monobutyl ester', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:925-21-3', 'https://commonchemistry.cas.org/detail?cas_rn=925-21-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Monobutyl maleate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:925-21-3', 'https://commonchemistry.cas.org/detail?cas_rn=925-21-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}]	group_key=4-butoxy-4-oxobut-2-enoicacid\|\|dimension=Environmental > media=Ground > geography=Unknown; cas=925-21-3; added Common Chemistry CAS names as altLabel: 2-Butenedioic acid (2<em>Z</em>)-, 1-butyl ester, 2-Butenedioic acid (2<em>Z</em>)-, monobutyl ester, 2-Butenedioic acid (<em>Z</em>)-, monobutyl ester, Butyl hydrogen maleate, Hydrogen butyl maleate, Maleic acid monombutyl ester, Maleic acid, butyl ester, Maleic acid, monobutyl ester, Monobutyl maleate; object_uuid=fo-08d9631c493b6b97
`cas_match_labels`	`None`	`{'925-21-3': 'exactMatch'}`	group_key=4-butoxy-4-oxobut-2-enoicacid\|\|dimension=Environmental > media=Ground > geography=Unknown; group_sources=['ec_inventory']; cas_sources={'925-21-3': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-08d9631c493b6b97: {'925-21-3': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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        "(E)-4-butoxy-4-oxo-but-2-enoic acid",
        "(E)-4-butoxy-4-oxobut-2-enoic acid",
        "(Z)-4-butoxy-4-keto-but-2-enoate",
        "(Z)-4-butoxy-4-keto-but-2-enoic acid",
        "(Z)-4-butoxy-4-oxidanylidene-but-2-enoate",
        "(Z)-4-butoxy-4-oxidanylidene-but-2-enoic acid",
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