(2,3-dichlorophenyl)(oxo)acetonitrile

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(2,3-dichlorophenyl)(oxo)acetonitrile

UUID 2a5531be-9e2d-4bf0-886a-3f54be87acc0

Flow Object ID fo-a28403e0b591202a

Source EF 3.1

Context Environmental → Ground → Unknown

CAS Numbers 77668-42-9

EC Numbers 278-747-9

prefLabel

Language	Value	Provenance
`en`	`(2,3-dichlorophenyl)(oxo)acetonitrile`

altLabel ⓘ

Language	Value	Provenance
`en`	`2,3-Dichloro-α-oxobenzeneacetonitrile`
`en`	`2,3-Dichlorobenzoyl cyanide`
`en`	`2,3-Dichlorobenzoyl nitrile`
`en`	`2-(2,3-Dichlorophenyl)-2-oxoacetonitrile`
`en`	`Benzeneacetonitrile, 2,3-dichloro-α-oxo-`

References

Shared Properties

Predicate	Value
InChIKey	`AMKMYXVFAOJGGQ-UHFFFAOYSA-N, FIBBFBXFASKAON-UHFFFAOYSA-N, YYLJITLTLPMJOE-ALCCZGGFSA-N`
InChI	`InChI=1S/C8H11NO/c1-9-6-7-2-4-8(10)5-3-7/h2-5,9-10H,6H2,1H3, InChI=1S/C8H3Cl2NO/c9-6-3-1-2-5(8(6)10)7(12)4-11/h1-3H, InChI=1S/C8H5Cl2NO/c9-6-3-1-2-5(8(6)10)7(12)4-11/h1-3,8,12H/b7-5-`
IUPAC name	(2Z)-2-(5,6-dichloro-1-cyclohexa-2,4-dienylidene)-2-hydroxyacetonitrile, (2Z)-2-(5,6-dichlorocyclohexa-2,4-dien-1-ylidene)-2-hydroxy-acetonitrile, (2Z)-2-(5,6-dichlorocyclohexa-2,4-dien-1-ylidene)-2-hydroxyacetonitrile, (2Z)-2-[5,6-bis(chloranyl)cyclohexa-2,4-dien-1-ylidene]-2-oxidanyl-ethanenitrile, 2,3-dichlorobenzoyl cyanide, 2-(2,3-dichlorophenyl)-2-keto-acetonitrile, 2-(2,3-dichlorophenyl)-2-oxoacetonitrile, 2-[2,3-bis(chloranyl)phenyl]-2-oxidanylidene-ethanenitrile, 4-(methylaminomethyl)phenol
Molecular formula	`C8H11NO, C8H3Cl2NO, C8H5Cl2NO`
SMILES	`C1=C/C(=C(\C#N)/O)/C(C(=C1)Cl)Cl, C1=CC(=C(C#N)O)C(C(=C1)Cl)Cl, C1=CC(=C(C(=C1)Cl)Cl)C(=O)C#N, CNCC1=CC=C(C=C1)O`

Source List References

List	Version	Source Flow UUID	Source Flow Name
EF	3.1	`2a5531be-9e2d-4bf0-886a-3f54be87acc0`	(2,3-dichlorophenyl)(oxo)acetonitrile

Concept Associations

Source List	Source Flow	Source Context	Unit	Match Type	Conversion	Provenance
EF 3.1	(2,3-dichlorophenyl)(oxo)acetonitrile	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=(2,3-dichlorophenyl)(oxo)acetonitrile\|\|dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); cas=77668-42-9; added Common Chemistry CAS names as altLabel: 2,3-Dichloro-α-oxobenzeneacetonitrile, 2,3-Dichlorobenzoyl cyanide, 2,3-Dichlorobenzoyl nitrile, 2-(2,3-Dichlorophenyl)-2-oxoacetonitrile, Benzeneacetonitrile, 2,3-dichloro-α-oxo-; object_uuid=fo-a28403e0b591202a
`cas_match_labels`	1	`—`	consensus_match	group_key=(2,3-dichlorophenyl)(oxo)acetonitrile\|\|dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'77668-42-9': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-a28403e0b591202a: {'77668-42-9': 'exactMatch'}

Context Attributes

Attribute	Value
dimension	Environmental
media	Ground
geography	Unknown

Consensus Changes

Field	Old Value	New Value	Comment
`altLabel`	`None`	[{'@value': '2,3-Dichloro-α-oxobenzeneacetonitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:77668-42-9', 'https://commonchemistry.cas.org/detail?cas_rn=77668-42-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '2,3-Dichlorobenzoyl cyanide', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:77668-42-9', 'https://commonchemistry.cas.org/detail?cas_rn=77668-42-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '2,3-Dichlorobenzoyl nitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:77668-42-9', 'https://commonchemistry.cas.org/detail?cas_rn=77668-42-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '2-(2,3-Dichlorophenyl)-2-oxoacetonitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:77668-42-9', 'https://commonchemistry.cas.org/detail?cas_rn=77668-42-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Benzeneacetonitrile, 2,3-dichloro-α-oxo-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:77668-42-9', 'https://commonchemistry.cas.org/detail?cas_rn=77668-42-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}]	group_key=(2,3-dichlorophenyl)(oxo)acetonitrile\|\|dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); cas=77668-42-9; added Common Chemistry CAS names as altLabel: 2,3-Dichloro-α-oxobenzeneacetonitrile, 2,3-Dichlorobenzoyl cyanide, 2,3-Dichlorobenzoyl nitrile, 2-(2,3-Dichlorophenyl)-2-oxoacetonitrile, Benzeneacetonitrile, 2,3-dichloro-α-oxo-; object_uuid=fo-a28403e0b591202a
`cas_match_labels`	`None`	`{'77668-42-9': 'exactMatch'}`	group_key=(2,3-dichlorophenyl)(oxo)acetonitrile\|\|dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'77668-42-9': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-a28403e0b591202a: {'77668-42-9': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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