Dinitrotoluene

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UUID 08a91e70-3ddc-11dd-9007-0050c2490048

Deprecated yes

Replaced By 08a91e70-3ddc-11dd-8fff-0050c2490048

Flow Object ID fo-0bb7a87c3b4f4c07

Source EF 3.1

Context Environmental → Ground → Unknown

CAS Numbers 25321-14-6

EC Numbers 246-836-1

prefLabel

Language	Value	Provenance
`en`	`Dinitrotoluene`

altLabel ⓘ

Language	Value	Provenance
`en`	`Benzene, methyldinitro-`
`en`	`DNT`
`en`	`Dinitrophenylmethane`
`en`	`Dinitrotoluol`
`en`	`Methyldinitrobenzene`
`en`	`Toluene, <em>ar</em>,<em>ar</em>-dinitro-`

References

Shared Properties

Predicate	Value
InChIKey	`DYSXLQBUUOPLBB-UHFFFAOYSA-N, RMBFBMJGBANMMK-UHFFFAOYSA-N, ZLSGOVJHNMUKTF-UHFFFAOYSA-N`
InChI	`InChI=1S/C7H6N2O4/c1-5-2-3-6(8(10)11)4-7(5)9(12)13/h2-4H,1H3, InChI=1S/C7H6N2O4/c1-5-3-2-4-6(8(10)11)7(5)9(12)13/h2-4H,1H3, InChI=1S/C7H8.2HNO2/c1-7-5-3-2-4-6-7;22-1-3/h2-6H,1H3;2(H,2,3)`
IUPAC name	`1-methyl-2,3-dinitro-benzene, 1-methyl-2,3-dinitrobenzene, 1-methyl-2,4-dinitro-benzene, 1-methyl-2,4-dinitrobenzene, methylbenzene;nitrous acid, nitrous acid;toluene`
Molecular formula	`C7H10N2O4, C7H6N2O4`
SMILES	`CC1=C(C(=CC=C1)[N+](=O)[O-])[N+](=O)[O-], CC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-], CC1=CC=CC=C1.N(=O)O.N(=O)O`

Source List References

List	Version	Source Flow UUID	Source Flow Name
EF	3.1	`08a91e70-3ddc-11dd-9007-0050c2490048`	dinitrotoluene

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=dinitrotoluene\|\|dimension=Environmental > media=Ground > geography=Agricultural; cas=25321-14-6; added Common Chemistry CAS names as altLabel: Benzene, methyldinitro-, DNT, Dinitrophenylmethane, Dinitrotoluol, Methyldinitrobenzene, Toluene, <em>ar</em>,<em>ar</em>-dinitro-; object_uuid=fo-0bb7a87c3b4f4c07
`cas_match_labels`	1	`—`	consensus_match	group_key=dinitrotoluene\|\|dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['ec_inventory', 'pubchem']; cas_sources={'25321-14-6': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-0bb7a87c3b4f4c07: {'25321-14-6': 'exactMatch'}

Context Attributes

Attribute	Value
dimension	Environmental
media	Ground
geography	Unknown

Consensus Changes

Field	Old Value	New Value	Comment
`altLabel`	`None`	[{'@value': 'Benzene, methyldinitro-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:25321-14-6', 'https://commonchemistry.cas.org/detail?cas_rn=25321-14-6'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'DNT', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:25321-14-6', 'https://commonchemistry.cas.org/detail?cas_rn=25321-14-6'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Dinitrophenylmethane', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:25321-14-6', 'https://commonchemistry.cas.org/detail?cas_rn=25321-14-6'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Dinitrotoluol', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:25321-14-6', 'https://commonchemistry.cas.org/detail?cas_rn=25321-14-6'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Methyldinitrobenzene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:25321-14-6', 'https://commonchemistry.cas.org/detail?cas_rn=25321-14-6'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Toluene, <em>ar</em>,<em>ar</em>-dinitro-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:25321-14-6', 'https://commonchemistry.cas.org/detail?cas_rn=25321-14-6'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}]	group_key=dinitrotoluene\|\|dimension=Environmental > media=Ground > geography=Agricultural; cas=25321-14-6; added Common Chemistry CAS names as altLabel: Benzene, methyldinitro-, DNT, Dinitrophenylmethane, Dinitrotoluol, Methyldinitrobenzene, Toluene, <em>ar</em>,<em>ar</em>-dinitro-; object_uuid=fo-0bb7a87c3b4f4c07
`cas_match_labels`	`None`	`{'25321-14-6': 'exactMatch'}`	group_key=dinitrotoluene\|\|dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['ec_inventory', 'pubchem']; cas_sources={'25321-14-6': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-0bb7a87c3b4f4c07: {'25321-14-6': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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