2-[bis(cyanomethyl)amino]acetonitrile

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2-[bis(cyanomethyl)amino]acetonitrile

UUID 246594b9-1e2d-4ed8-8e65-f4a521978fbc

Flow Object ID fo-b036ea84780926b6

Source EF 3.1

Context Environmental → Ground → Unknown

CAS Numbers 7327-60-8

EC Numbers 230-804-9

prefLabel

Language	Value	Provenance
`en`	`2-[bis(cyanomethyl)amino]acetonitrile`

altLabel ⓘ

Language	Value	Provenance
`en`	`2,2′,2′′-Nitrilotriacetonitrile`
`en`	`2,2′,2′′-Nitrilotris[acetonitrile]`
`en`	`Acetonitrile, 2,2′,2′′-nitrilotris-`
`en`	`Acetonitrile, nitrilotri-`
`en`	`NSC 93814`
`en`	`Nitrilotriacetonitrile`
`en`	`Nitrilotrisacetonitrile`
`en`	`α-Aminotriacetonitrile`

References

Shared Properties

Predicate	Value
InChIKey	`JMANVNJQNLATNU-UHFFFAOYSA-N, LJAIDEYQVIJERM-UHFFFAOYSA-N, SSQIIGCIWQHQGZ-UHFFFAOYSA-N`
InChI	`InChI=1S/C18H27NO/c1-14(2)16-7-9-17(10-8-16)18(20)15(3)13-19-11-5-4-6-12-19/h7-10,14-15H,4-6,11-13H2,1-3H3, InChI=1S/C2N2/c3-1-2-4, InChI=1S/C6H6N4/c7-1-4-10(5-2-8)6-3-9/h4-6H2`
IUPAC name	`1-(4-isopropylphenyl)-2-methyl-3-(1-piperidyl)propan-1-one, 2-[bis(cyanomethyl)amino]acetonitrile, 2-[bis(cyanomethyl)amino]ethanenitrile, 2-methyl-1-p-cumenyl-3-piperidino-propan-1-one, 2-methyl-3-(1-piperidinyl)-1-(4-propan-2-ylphenyl)-1-propanone, 2-methyl-3-piperidin-1-yl-1-(4-propan-2-ylphenyl)propan-1-one, cyanogen, ethanedinitrile, oxalonitrile`
Molecular formula	`C18H27NO, C2N2, C6H6N4`
SMILES	`C(#N)C#N, C(C#N)N(CC#N)CC#N, CC(C)C1=CC=C(C=C1)C(=O)C(C)CN2CCCCC2`

Source List References

List	Version	Source Flow UUID	Source Flow Name
EF	3.1	`246594b9-1e2d-4ed8-8e65-f4a521978fbc`	2-[bis(cyanomethyl)amino]acetonitrile

Concept Associations

Source List	Source Flow	Source Context	Unit	Match Type	Conversion	Provenance
EF 3.1	2-[bis(cyanomethyl)amino]acetonitrile	Emissions/Emissions to soil/Emissions to soil, unspecified	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-[bis(cyanomethyl)amino]acetonitrile\|\|dimension=Environmental > media=Water > water_body=Surface water; cas=7327-60-8; added Common Chemistry CAS names as altLabel: 2,2′,2′′-Nitrilotriacetonitrile, 2,2′,2′′-Nitrilotris[acetonitrile], Acetonitrile, 2,2′,2′′-nitrilotris-, Acetonitrile, nitrilotri-, NSC 93814, Nitrilotriacetonitrile, Nitrilotrisacetonitrile, α-Aminotriacetonitrile; object_uuid=fo-b036ea84780926b6
`cas_match_labels`	1	`—`	consensus_match	group_key=2-[bis(cyanomethyl)amino]acetonitrile\|\|dimension=Environmental > media=Water > water_body=Surface water; group_sources=['ec_inventory', 'pubchem']; cas_sources={'7327-60-8': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-b036ea84780926b6: {'7327-60-8': 'exactMatch'}

Context Attributes

Attribute	Value
dimension	Environmental
media	Ground
geography	Unknown

Consensus Changes

Field	Old Value	New Value	Comment
`altLabel`	`None`	[{'@value': '2,2′,2′′-Nitrilotriacetonitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:7327-60-8', 'https://commonchemistry.cas.org/detail?cas_rn=7327-60-8'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '2,2′,2′′-Nitrilotris[acetonitrile]', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:7327-60-8', 'https://commonchemistry.cas.org/detail?cas_rn=7327-60-8'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Acetonitrile, 2,2′,2′′-nitrilotris-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:7327-60-8', 'https://commonchemistry.cas.org/detail?cas_rn=7327-60-8'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Acetonitrile, nitrilotri-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:7327-60-8', 'https://commonchemistry.cas.org/detail?cas_rn=7327-60-8'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'NSC 93814', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:7327-60-8', 'https://commonchemistry.cas.org/detail?cas_rn=7327-60-8'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Nitrilotriacetonitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:7327-60-8', 'https://commonchemistry.cas.org/detail?cas_rn=7327-60-8'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Nitrilotrisacetonitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:7327-60-8', 'https://commonchemistry.cas.org/detail?cas_rn=7327-60-8'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'α-Aminotriacetonitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:7327-60-8', 'https://commonchemistry.cas.org/detail?cas_rn=7327-60-8'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}]	group_key=2-[bis(cyanomethyl)amino]acetonitrile\|\|dimension=Environmental > media=Water > water_body=Surface water; cas=7327-60-8; added Common Chemistry CAS names as altLabel: 2,2′,2′′-Nitrilotriacetonitrile, 2,2′,2′′-Nitrilotris[acetonitrile], Acetonitrile, 2,2′,2′′-nitrilotris-, Acetonitrile, nitrilotri-, NSC 93814, Nitrilotriacetonitrile, Nitrilotrisacetonitrile, α-Aminotriacetonitrile; object_uuid=fo-b036ea84780926b6
`cas_match_labels`	`None`	`{'7327-60-8': 'exactMatch'}`	group_key=2-[bis(cyanomethyl)amino]acetonitrile\|\|dimension=Environmental > media=Water > water_body=Surface water; group_sources=['ec_inventory', 'pubchem']; cas_sources={'7327-60-8': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-b036ea84780926b6: {'7327-60-8': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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