6-nitrobenzimidazole

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UUID e2fb52f1-6555-11dd-ad8b-0800200c9a66

Flow Object ID fo-8abc213cee07c121

Source EF 3.1

Context Environmental → Air → Aircraft cruise height

CAS Numbers 94-52-0

EC Numbers 202-341-2

prefLabel

Language	Value	Provenance
`en`	`6-nitrobenzimidazole`

altLabel ⓘ

Language	Value	Provenance
`en`	`1<em>H</em>-Benzimidazole, 5-nitro-`
`en`	`1<em>H</em>-Benzimidazole, 6-nitro-`
`en`	`5(6)-Nitrobenzimidazole`
`en`	`5-Nitro-1<em>H</em>-benzimidazole`
`en`	`5-Nitrobenzimidazole`
`en`	`6-Nitro-1<em>H</em>-benzimidazole`
`en`	`6-Nitro-1<em>H</em>-benzo[<em>d</em>]imidazole`
`en`	`Benzimidazole, 5(<em>or</em> 6)-nitro-`
`en`	`Benzimidazole, 5-nitro-`
`en`	`NSC 3068`
`en`	`NSC 58858`

References

Shared Properties

Predicate	Value
InChIKey	`VSCHBPCWJOQPQD-UHFFFAOYSA-N, WDEMOZOGTCVBEX-UHFFFAOYSA-N, XPAZGLFMMUODDK-UHFFFAOYSA-N`
InChI	`InChI=1S/C14H11N5O4/c1-23-14(20)10-6-12(17-4-2-15-8-17)13(7-11(10)19(21)22)18-5-3-16-9-18/h2-9H,1H3, InChI=1S/C18H14O2/c1-20-18(19)17-11-5-4-10-16(17)15-12-6-8-13-7-2-3-9-14(13)15/h2-12H,1H3, InChI=1S/C7H5N3O2/c11-10(12)5-1-2-6-7(3-5)9-4-8-6/h1-4H,(H,8,9)`
IUPAC name	`2-(1-naphthalenyl)benzoic acid methyl ester, 2-(1-naphthyl)benzoic acid methyl ester, 4,5-bis(1-imidazolyl)-2-nitrobenzoic acid methyl ester, 4,5-di(imidazol-1-yl)-2-nitro-benzoic acid methyl ester, 6-nitro-1H-benzimidazole, methyl 2-(1-naphthyl)benzoate, methyl 2-naphthalen-1-ylbenzoate, methyl 4,5-di(imidazol-1-yl)-2-nitro-benzoate, methyl 4,5-di(imidazol-1-yl)-2-nitrobenzoate`
Molecular formula	`C14H11N5O4, C18H14O2, C7H5N3O2`
SMILES	`C1=CC2=C(C=C1[N+](=O)[O-])NC=N2, COC(=O)C1=CC(=C(C=C1[N+](=O)[O-])N2C=CN=C2)N3C=CN=C3, COC(=O)C1=CC=CC=C1C2=CC=CC3=CC=CC=C32`

Source List References

List	Version	Source Flow UUID	Source Flow Name
EF	3.1	`e2fb52f1-6555-11dd-ad8b-0800200c9a66`	6-nitrobenzimidazole

Concept Associations

Source List	Source Flow	Source Context	Unit	Match Type	Conversion	Provenance
EF 3.1	6-nitrobenzimidazole	Emissions/Emissions to air/Emissions to lower stratosphere and upper troposphere	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=6-nitrobenzimidazole\|\|dimension=Environmental > media=Ground > geography=Agricultural; cas=94-52-0; added Common Chemistry CAS names as altLabel: 1<em>H</em>-Benzimidazole, 5-nitro-, 1<em>H</em>-Benzimidazole, 6-nitro-, 5(6)-Nitrobenzimidazole, 5-Nitro-1<em>H</em>-benzimidazole, 5-Nitrobenzimidazole, 6-Nitro-1<em>H</em>-benzimidazole, 6-Nitro-1<em>H</em>-benzo[<em>d</em>]imidazole, Benzimidazole, 5(<em>or</em> 6)-nitro-, Benzimidazole, 5-nitro-, NSC 3068, NSC 58858; object_uuid=fo-8abc213cee07c121
`cas_match_labels`	1	`—`	consensus_match	group_key=6-nitrobenzimidazole\|\|dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['ec_inventory', 'pubchem']; cas_sources={'94-52-0': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-8abc213cee07c121: {'94-52-0': 'exactMatch'}

Context Attributes

Attribute	Value
dimension	Environmental
media	Air
strata	Aircraft cruise height

Consensus Changes

Field	Old Value	New Value	Comment
`altLabel`	`None`	[{'@value': '1<em>H</em>-Benzimidazole, 5-nitro-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:94-52-0', 'https://commonchemistry.cas.org/detail?cas_rn=94-52-0'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '1<em>H</em>-Benzimidazole, 6-nitro-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:94-52-0', 'https://commonchemistry.cas.org/detail?cas_rn=94-52-0'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '5(6)-Nitrobenzimidazole', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:94-52-0', 'https://commonchemistry.cas.org/detail?cas_rn=94-52-0'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '5-Nitro-1<em>H</em>-benzimidazole', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:94-52-0', 'https://commonchemistry.cas.org/detail?cas_rn=94-52-0'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '5-Nitrobenzimidazole', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:94-52-0', 'https://commonchemistry.cas.org/detail?cas_rn=94-52-0'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '6-Nitro-1<em>H</em>-benzimidazole', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:94-52-0', 'https://commonchemistry.cas.org/detail?cas_rn=94-52-0'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '6-Nitro-1<em>H</em>-benzo[<em>d</em>]imidazole', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:94-52-0', 'https://commonchemistry.cas.org/detail?cas_rn=94-52-0'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Benzimidazole, 5(<em>or</em> 6)-nitro-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:94-52-0', 'https://commonchemistry.cas.org/detail?cas_rn=94-52-0'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Benzimidazole, 5-nitro-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:94-52-0', 'https://commonchemistry.cas.org/detail?cas_rn=94-52-0'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'NSC 3068', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:94-52-0', 'https://commonchemistry.cas.org/detail?cas_rn=94-52-0'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'NSC 58858', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:94-52-0', 'https://commonchemistry.cas.org/detail?cas_rn=94-52-0'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}]	group_key=6-nitrobenzimidazole\|\|dimension=Environmental > media=Ground > geography=Agricultural; cas=94-52-0; added Common Chemistry CAS names as altLabel: 1<em>H</em>-Benzimidazole, 5-nitro-, 1<em>H</em>-Benzimidazole, 6-nitro-, 5(6)-Nitrobenzimidazole, 5-Nitro-1<em>H</em>-benzimidazole, 5-Nitrobenzimidazole, 6-Nitro-1<em>H</em>-benzimidazole, 6-Nitro-1<em>H</em>-benzo[<em>d</em>]imidazole, Benzimidazole, 5(<em>or</em> 6)-nitro-, Benzimidazole, 5-nitro-, NSC 3068, NSC 58858; object_uuid=fo-8abc213cee07c121
`cas_match_labels`	`None`	`{'94-52-0': 'exactMatch'}`	group_key=6-nitrobenzimidazole\|\|dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['ec_inventory', 'pubchem']; cas_sources={'94-52-0': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-8abc213cee07c121: {'94-52-0': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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