Dimethyl Adipate

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UUID 4d9a8790-3ddd-11dd-9c6f-0050c2490048

Flow Object ID fo-05919fc674bc1fda

Source EF 3.1

Context Environmental → Air → Ground level → Rural (<1000 people/square mile)

CAS Numbers 627-93-0

EC Numbers 211-020-6

prefLabel

Language	Value	Provenance
`en`	`Dimethyl Adipate`

altLabel ⓘ

Language	Value	Provenance
`en`	`Dimethyl hexanedioate`
`en`	`Adipic acid, dimethyl ester`
`en`	`Adipinic acid dimethyl ester`
`en`	`DBE 6`
`en`	`Dimethyl 1,6-hexanedioate`
`en`	`Hexanedioic acid, 1,6-dimethyl ester`
`en`	`Hexanedioic acid, dimethyl ester`
`en`	`Methyl adipate`
`en`	`NSC 11213`

References

Shared Properties

Predicate	Value
Formal charge	`0`
InChIKey	`UDSFAEKRVUSQDD-UHFFFAOYSA-N`
InChI	`InChI=1S/C8H14O4/c1-11-7(9)5-3-4-6-8(10)12-2/h3-6H2,1-2H3`
IUPAC name	`adipic acid dimethyl ester, dimethyl hexanedioate, hexanedioic acid dimethyl ester`
Molecular formula	`C8H14O4`
Molecular mass	`174.196`
Monoisotopic mass	`174.08921`
SMILES	`COC(=O)CCCCC(=O)OC`

Source List References

List	Version	Source Flow UUID	Source Flow Name
EF	3.1	`4d9a8790-3ddd-11dd-9c6f-0050c2490048`	dimethyl adipate

Concept Associations

Source List	Source Flow	Source Context	Unit	Match Type	Conversion	Provenance
EF 3.1	dimethyl adipate	Emissions/Emissions to air/Emissions to air, unspecified (long-term)	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=dimethyladipate\|\|dimension=Environmental > media=Ground > geography=Agricultural; cas=627-93-0; added Common Chemistry CAS names as altLabel: Adipic acid, dimethyl ester, Adipinic acid dimethyl ester, DBE 6, Dimethyl 1,6-hexanedioate, Hexanedioic acid, 1,6-dimethyl ester, Hexanedioic acid, dimethyl ester, Methyl adipate, NSC 11213; object_uuid=fo-05919fc674bc1fda
`cas_match_labels`	1	`—`	consensus_match	group_key=dimethyladipate\|\|dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'627-93-0': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-05919fc674bc1fda: {'627-93-0': 'exactMatch'}

Context Attributes

Attribute	Value
dimension	Environmental
media	Air
strata	Ground level
population_density	Rural (<1000 people/square mile)

Consensus Changes

Field	Old Value	New Value	Comment
`altLabel`	`[{'@value': 'Dimethyl hexanedioate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Dimethyl hexanedioate', 'http://purl.obolibrary.org/obo/CHEBI_34715', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}]`	[{'@value': 'Dimethyl hexanedioate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Dimethyl hexanedioate', 'http://purl.obolibrary.org/obo/CHEBI_34715', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Adipic acid, dimethyl ester', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:627-93-0', 'https://commonchemistry.cas.org/detail?cas_rn=627-93-0'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Adipinic acid dimethyl ester', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:627-93-0', 'https://commonchemistry.cas.org/detail?cas_rn=627-93-0'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'DBE 6', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:627-93-0', 'https://commonchemistry.cas.org/detail?cas_rn=627-93-0'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Dimethyl 1,6-hexanedioate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:627-93-0', 'https://commonchemistry.cas.org/detail?cas_rn=627-93-0'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Hexanedioic acid, 1,6-dimethyl ester', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:627-93-0', 'https://commonchemistry.cas.org/detail?cas_rn=627-93-0'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Hexanedioic acid, dimethyl ester', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:627-93-0', 'https://commonchemistry.cas.org/detail?cas_rn=627-93-0'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Methyl adipate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:627-93-0', 'https://commonchemistry.cas.org/detail?cas_rn=627-93-0'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'NSC 11213', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:627-93-0', 'https://commonchemistry.cas.org/detail?cas_rn=627-93-0'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}]	group_key=dimethyladipate\|\|dimension=Environmental > media=Ground > geography=Agricultural; cas=627-93-0; added Common Chemistry CAS names as altLabel: Adipic acid, dimethyl ester, Adipinic acid dimethyl ester, DBE 6, Dimethyl 1,6-hexanedioate, Hexanedioic acid, 1,6-dimethyl ester, Hexanedioic acid, dimethyl ester, Methyl adipate, NSC 11213; object_uuid=fo-05919fc674bc1fda
`cas_match_labels`	`None`	`{'627-93-0': 'exactMatch'}`	group_key=dimethyladipate\|\|dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'627-93-0': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-05919fc674bc1fda: {'627-93-0': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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