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2-nitrotoluene

UUID 5e3f96e4-6aad-480d-a732-60bfe8950410
Flow Object IDfo-b32d51587ee070e2
Source EF 3.1
Context Environmental → Air → Unknown
CAS Numbers 88-72-2
EC Numbers 201-853-3
prefLabel
Language Value Provenance
en 2-nitrotoluene
altLabel ⓘ
Language Value Provenance
en 1-methyl-2-nitrobenzene
en 2-Nitrotoluol
en 2-methyl-1-nitrobenzene
en ONT
en o-Nitrotoluol
en o-methylnitrobenzene
en o-nitrotoluene
en ortho-Nitrotoluol
en 2-Methylnitrobenzene
en <em>o</em>-Methylnitrobenzene
en <em>o</em>-Mononitrotoluene
en <em>o</em>-Nitrotoluene
en Benzene, 1-methyl-2-nitro-
en NSC 9577
en Toluene, <em>o</em>-nitro-
Definitions
Language Value Provenance
en A mononitrotoluene that is toluene carrying a nitro substituent at position 2.
References
Shared Properties
Predicate Value
Formal charge 0
InChIKey PLAZTCDQAHEYBI-UHFFFAOYSA-N
InChI InChI=1S/C7H7NO2/c1-6-4-2-3-5-7(6)8(9)10/h2-5H,1H3
IUPAC name 1-methyl-2-nitro-benzene, 1-methyl-2-nitrobenzene
Molecular formula C7H7NO2
Molecular mass 137.138
Monoisotopic mass 137.04768
SMILES CC1=CC=CC=C1[N+](=O)[O-], Cc1ccccc1[N+](=O)[O-]

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 5e3f96e4-6aad-480d-a732-60bfe8950410 2-nitrotoluene

Concept Associations

Source List Source Flow Source Context Unit Match Type Conversion Provenance
EF 3.1 2-nitrotoluene Emissions/Emissions to air/Emissions to air, 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-nitrotoluene||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); cas=88-72-2; added Common Chemistry CAS names as altLabel: 2-Methylnitrobenzene, <em>o</em>-Methylnitrobenzene, <em>o</em>-Mononitrotoluene, <em>o</em>-Nitrotoluene, Benzene, 1-methyl-2-nitro-, NSC 9577, Toluene, <em>o</em>-nitro-; object_uuid=fo-b32d51587ee070e2
cas_match_labels 1 — consensus_match group_key=2-nitrotoluene||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'88-72-2': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-b32d51587ee070e2: {'88-72-2': 'exactMatch'}

Context Attributes

AttributeValue
dimensionEnvironmental
mediaAir
strataUnknown

Consensus Changes

Field Old Value New Value Comment
altLabel [{'@value': '1-methyl-2-nitrobenzene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:1-methyl-2-nitrobenzene', 'http://purl.obolibrary.org/obo/CHEBI_33098', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '2-Nitrotoluol', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:2-Nitrotoluol', 'http://purl.obolibrary.org/obo/CHEBI_33098', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '2-methyl-1-nitrobenzene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:2-methyl-1-nitrobenzene', 'http://purl.obolibrary.org/obo/CHEBI_33098', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'ONT', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:ONT', 'http://purl.obolibrary.org/obo/CHEBI_33098', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'o-Nitrotoluol', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:o-Nitrotoluol', 'http://purl.obolibrary.org/obo/CHEBI_33098', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'o-methylnitrobenzene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:o-methylnitrobenzene', 'http://purl.obolibrary.org/obo/CHEBI_33098', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'o-nitrotoluene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:o-nitrotoluene', 'http://purl.obolibrary.org/obo/CHEBI_33098', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'ortho-Nitrotoluol', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:ortho-Nitrotoluol', 'http://purl.obolibrary.org/obo/CHEBI_33098', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}] [{'@value': '1-methyl-2-nitrobenzene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:1-methyl-2-nitrobenzene', 'http://purl.obolibrary.org/obo/CHEBI_33098', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '2-Nitrotoluol', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:2-Nitrotoluol', 'http://purl.obolibrary.org/obo/CHEBI_33098', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '2-methyl-1-nitrobenzene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:2-methyl-1-nitrobenzene', 'http://purl.obolibrary.org/obo/CHEBI_33098', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'ONT', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:ONT', 'http://purl.obolibrary.org/obo/CHEBI_33098', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'o-Nitrotoluol', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:o-Nitrotoluol', 'http://purl.obolibrary.org/obo/CHEBI_33098', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'o-methylnitrobenzene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:o-methylnitrobenzene', 'http://purl.obolibrary.org/obo/CHEBI_33098', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'o-nitrotoluene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:o-nitrotoluene', 'http://purl.obolibrary.org/obo/CHEBI_33098', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'ortho-Nitrotoluol', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:ortho-Nitrotoluol', 'http://purl.obolibrary.org/obo/CHEBI_33098', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '2-Methylnitrobenzene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:88-72-2', 'https://commonchemistry.cas.org/detail?cas_rn=88-72-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '<em>o</em>-Methylnitrobenzene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:88-72-2', 'https://commonchemistry.cas.org/detail?cas_rn=88-72-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '<em>o</em>-Mononitrotoluene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:88-72-2', 'https://commonchemistry.cas.org/detail?cas_rn=88-72-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '<em>o</em>-Nitrotoluene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:88-72-2', 'https://commonchemistry.cas.org/detail?cas_rn=88-72-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Benzene, 1-methyl-2-nitro-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:88-72-2', 'https://commonchemistry.cas.org/detail?cas_rn=88-72-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'NSC 9577', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:88-72-2', 'https://commonchemistry.cas.org/detail?cas_rn=88-72-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Toluene, <em>o</em>-nitro-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:88-72-2', 'https://commonchemistry.cas.org/detail?cas_rn=88-72-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=2-nitrotoluene||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); cas=88-72-2; added Common Chemistry CAS names as altLabel: 2-Methylnitrobenzene, <em>o</em>-Methylnitrobenzene, <em>o</em>-Mononitrotoluene, <em>o</em>-Nitrotoluene, Benzene, 1-methyl-2-nitro-, NSC 9577, Toluene, <em>o</em>-nitro-; object_uuid=fo-b32d51587ee070e2
cas_match_labels None {'88-72-2': 'exactMatch'} group_key=2-nitrotoluene||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'88-72-2': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-b32d51587ee070e2: {'88-72-2': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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