2,4-dinitrotoluene

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UUID 08a91e70-3ddc-11dd-99ac-0050c2490048

Flow Object ID fo-32910fbc1d34562a

Source EF 3.1

Context Environmental → Air → High stack, >150 meters

CAS Numbers 121-14-2

EC Numbers 204-450-0

prefLabel

Language	Value	Provenance
`en`	`2,4-dinitrotoluene`

altLabel ⓘ

Language	Value	Provenance
`en`	`1-methyl-2,4-dinitrobenzene`
`en`	`2,4-DNT`
`en`	`2,4-dinitro-1-methylbenzene`
`en`	`2,4-dinitromethylbenzene`
`en`	`2,4-dinitrotoluol`
`en`	`DNT`
`en`	`4-Methyl-1,3-dinitrobenzene`
`en`	`6-Methyl-1,3-dinitrobenzene`
`en`	`Benzene, 1-methyl-2,4-dinitro-`
`en`	`NSC 7194`
`en`	`Toluene, 2,4-dinitro-`

Definitions

Language	Value	Provenance
`en`	A dinitrotoluene in which the methyl group is ortho to one of the nitro groups and para to the other. It is the most common isomer of dinitrotoluene.

References

Shared Properties

Predicate	Value
Formal charge	`0`
InChIKey	`RMBFBMJGBANMMK-UHFFFAOYSA-N`
InChI	`InChI=1S/C7H6N2O4/c1-5-2-3-6(8(10)11)4-7(5)9(12)13/h2-4H,1H3`
IUPAC name	`1-methyl-2,4-dinitro-benzene, 1-methyl-2,4-dinitrobenzene`
Molecular formula	`C7H6N2O4`
Molecular mass	`182.135`
Monoisotopic mass	`182.03276`
SMILES	`CC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-], Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]`

Source List References

List	Version	Source Flow UUID	Source Flow Name
EF	3.1	`08a91e70-3ddc-11dd-99ac-0050c2490048`	2,4-dinitrotoluene

Concept Associations

Source List	Source Flow	Source Context	Unit	Match Type	Conversion	Provenance
EF 3.1	2,4-dinitrotoluene	Emissions/Emissions to air/Emissions to non-urban air or from high stacks	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=2,4-dinitrotoluene\|\|dimension=Environmental > media=Ground > geography=Agricultural; cas=121-14-2; added Common Chemistry CAS names as altLabel: 4-Methyl-1,3-dinitrobenzene, 6-Methyl-1,3-dinitrobenzene, Benzene, 1-methyl-2,4-dinitro-, NSC 7194, Toluene, 2,4-dinitro-; object_uuid=fo-32910fbc1d34562a
`cas_match_labels`	1	`—`	consensus_match	group_key=2,4-dinitrotoluene\|\|dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'121-14-2': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-32910fbc1d34562a: {'121-14-2': 'exactMatch'}

Context Attributes

Attribute	Value
dimension	Environmental
media	Air
strata	High stack, >150 meters

Consensus Changes

Field	Old Value	New Value	Comment
`altLabel`	[{'@value': '1-methyl-2,4-dinitrobenzene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:1-methyl-2,4-dinitrobenzene', 'http://purl.obolibrary.org/obo/CHEBI_920', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '2,4-DNT', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:2,4-DNT', 'http://purl.obolibrary.org/obo/CHEBI_920', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '2,4-dinitro-1-methylbenzene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:2,4-dinitro-1-methylbenzene', 'http://purl.obolibrary.org/obo/CHEBI_920', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '2,4-dinitromethylbenzene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:2,4-dinitromethylbenzene', 'http://purl.obolibrary.org/obo/CHEBI_920', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '2,4-dinitrotoluol', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:2,4-dinitrotoluol', 'http://purl.obolibrary.org/obo/CHEBI_920', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'DNT', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:DNT', 'http://purl.obolibrary.org/obo/CHEBI_920', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}]	[{'@value': '1-methyl-2,4-dinitrobenzene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:1-methyl-2,4-dinitrobenzene', 'http://purl.obolibrary.org/obo/CHEBI_920', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '2,4-DNT', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:2,4-DNT', 'http://purl.obolibrary.org/obo/CHEBI_920', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '2,4-dinitro-1-methylbenzene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:2,4-dinitro-1-methylbenzene', 'http://purl.obolibrary.org/obo/CHEBI_920', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '2,4-dinitromethylbenzene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:2,4-dinitromethylbenzene', 'http://purl.obolibrary.org/obo/CHEBI_920', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '2,4-dinitrotoluol', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:2,4-dinitrotoluol', 'http://purl.obolibrary.org/obo/CHEBI_920', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'DNT', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:DNT', 'http://purl.obolibrary.org/obo/CHEBI_920', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '4-Methyl-1,3-dinitrobenzene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:121-14-2', 'https://commonchemistry.cas.org/detail?cas_rn=121-14-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '6-Methyl-1,3-dinitrobenzene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:121-14-2', 'https://commonchemistry.cas.org/detail?cas_rn=121-14-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Benzene, 1-methyl-2,4-dinitro-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:121-14-2', 'https://commonchemistry.cas.org/detail?cas_rn=121-14-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'NSC 7194', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:121-14-2', 'https://commonchemistry.cas.org/detail?cas_rn=121-14-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Toluene, 2,4-dinitro-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:121-14-2', 'https://commonchemistry.cas.org/detail?cas_rn=121-14-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}]	group_key=2,4-dinitrotoluene\|\|dimension=Environmental > media=Ground > geography=Agricultural; cas=121-14-2; added Common Chemistry CAS names as altLabel: 4-Methyl-1,3-dinitrobenzene, 6-Methyl-1,3-dinitrobenzene, Benzene, 1-methyl-2,4-dinitro-, NSC 7194, Toluene, 2,4-dinitro-; object_uuid=fo-32910fbc1d34562a
`cas_match_labels`	`None`	`{'121-14-2': 'exactMatch'}`	group_key=2,4-dinitrotoluene\|\|dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'121-14-2': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-32910fbc1d34562a: {'121-14-2': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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