Dibutyl Fumarate

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UUID 65ed5118-4740-4956-a2db-8fa8a762e6d4

Flow Object ID fo-75e0777b9d9cf949

Source EF 3.1

Context Environmental → Ground → Unknown

CAS Numbers 105-75-9

EC Numbers 203-327-9

prefLabel

Language	Value	Provenance
`en`	`Dibutyl Fumarate`

altLabel ⓘ

Language	Value	Provenance
`en`	`2-Butenedioic acid (2<em>E</em>)-, 1,4-dibutyl ester`
`en`	`2-Butenedioic acid (2<em>E</em>)-, dibutyl ester`
`en`	`2-Butenedioic acid (<em>E</em>)-, dibutyl ester`
`en`	`Butyl fumarate`
`en`	`Fumaric acid di-<em>n</em>-butyl ester`
`en`	`Fumaric acid, dibutyl ester`
`en`	`NSC 140`
`en`	`RC Comonomer DBF`
`en`	`Staflex DBF`

References

Shared Properties

Predicate	Value
InChIKey	`JBSLOWBPDRZSMB-BQYQJAHWSA-N, JBSLOWBPDRZSMB-FPLPWBNLSA-N, JBSLOWBPDRZSMB-UHFFFAOYSA-N`
InChI	`InChI=1S/C12H20O4/c1-3-5-9-15-11(13)7-8-12(14)16-10-6-4-2/h7-8H,3-6,9-10H2,1-2H3, InChI=1S/C12H20O4/c1-3-5-9-15-11(13)7-8-12(14)16-10-6-4-2/h7-8H,3-6,9-10H2,1-2H3/b8-7+, InChI=1S/C12H20O4/c1-3-5-9-15-11(13)7-8-12(14)16-10-6-4-2/h7-8H,3-6,9-10H2,1-2H3/b8-7-`
IUPAC name	`(E)-2-butenedioic acid dibutyl ester, (E)-but-2-enedioic acid dibutyl ester, (Z)-2-butenedioic acid dibutyl ester, (Z)-but-2-enedioic acid dibutyl ester, 2-butenedioic acid dibutyl ester, but-2-enedioic acid dibutyl ester, dibutyl (E)-but-2-enedioate, dibutyl (Z)-but-2-enedioate, dibutyl but-2-enedioate`
Molecular formula	`C12H20O4`
SMILES	`CCCCOC(=O)/C=C/C(=O)OCCCC, CCCCOC(=O)/C=C\C(=O)OCCCC, CCCCOC(=O)C=CC(=O)OCCCC`

Source List References

List	Version	Source Flow UUID	Source Flow Name
EF	3.1	`65ed5118-4740-4956-a2db-8fa8a762e6d4`	dibutyl fumarate

Concept Associations

Source List	Source Flow	Source Context	Unit	Match Type	Conversion	Provenance
EF 3.1	dibutyl fumarate	Emissions/Emissions to soil/Emissions to non-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=dibutylfumarate\|\|dimension=Environmental > media=Water > water_body=Surface water; cas=105-75-9; added Common Chemistry CAS names as altLabel: 2-Butenedioic acid (2<em>E</em>)-, 1,4-dibutyl ester, 2-Butenedioic acid (2<em>E</em>)-, dibutyl ester, 2-Butenedioic acid (<em>E</em>)-, dibutyl ester, Butyl fumarate, Fumaric acid di-<em>n</em>-butyl ester, Fumaric acid, dibutyl ester, NSC 140, RC Comonomer DBF, Staflex DBF; object_uuid=fo-75e0777b9d9cf949
`cas_match_labels`	1	`—`	consensus_match	group_key=dibutylfumarate\|\|dimension=Environmental > media=Water > water_body=Surface water; group_sources=['ec_inventory', 'pubchem']; cas_sources={'105-75-9': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-75e0777b9d9cf949: {'105-75-9': 'exactMatch'}

Context Attributes

Attribute	Value
dimension	Environmental
media	Ground
geography	Unknown

Consensus Changes

Field	Old Value	New Value	Comment
`altLabel`	`None`	[{'@value': '2-Butenedioic acid (2<em>E</em>)-, 1,4-dibutyl ester', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:105-75-9', 'https://commonchemistry.cas.org/detail?cas_rn=105-75-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '2-Butenedioic acid (2<em>E</em>)-, dibutyl ester', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:105-75-9', 'https://commonchemistry.cas.org/detail?cas_rn=105-75-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '2-Butenedioic acid (<em>E</em>)-, dibutyl ester', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:105-75-9', 'https://commonchemistry.cas.org/detail?cas_rn=105-75-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Butyl fumarate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:105-75-9', 'https://commonchemistry.cas.org/detail?cas_rn=105-75-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Fumaric acid di-<em>n</em>-butyl ester', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:105-75-9', 'https://commonchemistry.cas.org/detail?cas_rn=105-75-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Fumaric acid, dibutyl ester', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:105-75-9', 'https://commonchemistry.cas.org/detail?cas_rn=105-75-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'NSC 140', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:105-75-9', 'https://commonchemistry.cas.org/detail?cas_rn=105-75-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'RC Comonomer DBF', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:105-75-9', 'https://commonchemistry.cas.org/detail?cas_rn=105-75-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Staflex DBF', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:105-75-9', 'https://commonchemistry.cas.org/detail?cas_rn=105-75-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}]	group_key=dibutylfumarate\|\|dimension=Environmental > media=Water > water_body=Surface water; cas=105-75-9; added Common Chemistry CAS names as altLabel: 2-Butenedioic acid (2<em>E</em>)-, 1,4-dibutyl ester, 2-Butenedioic acid (2<em>E</em>)-, dibutyl ester, 2-Butenedioic acid (<em>E</em>)-, dibutyl ester, Butyl fumarate, Fumaric acid di-<em>n</em>-butyl ester, Fumaric acid, dibutyl ester, NSC 140, RC Comonomer DBF, Staflex DBF; object_uuid=fo-75e0777b9d9cf949
`cas_match_labels`	`None`	`{'105-75-9': 'exactMatch'}`	group_key=dibutylfumarate\|\|dimension=Environmental > media=Water > water_body=Surface water; group_sources=['ec_inventory', 'pubchem']; cas_sources={'105-75-9': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-75e0777b9d9cf949: {'105-75-9': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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