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3-nitrotoluene

UUID 60175e1d-f78c-4117-aff2-67e5e962272b
Flow Object IDfo-073d15102af90188
Source EF 3.1
Context Environmental → Ground → Unknown
CAS Numbers 99-08-1
EC Numbers 202-728-6
prefLabel
Language Value Provenance
en 3-nitrotoluene
altLabel ⓘ
Language Value Provenance
en 1-methyl-3-nitrobenzene
en 3-Nitrotoluol
en m-Nitrotoluol
en m-methylnitrobenzene
en m-nitrotoluene
en meta-Nitrotoluol
en 1-Nitro-3-methylbenzene
en 3-Methyl-1-nitrobenzene
en 3-Methylnitrobenzene
en <em>m</em>-Methylnitrobenzene
en <em>m</em>-Mononitrotoluene
en <em>m</em>-Nitrotoluene
en Benzene, 1-methyl-3-nitro-
en MNT
en NSC 9578
en Toluene, <em>m</em>-nitro-
Definitions
Language Value Provenance
en A mononitrotoluene carrying a nitro group at position 3.
References
Shared Properties
Predicate Value
Formal charge 0
InChIKey QZYHIOPPLUPUJF-UHFFFAOYSA-N
InChI InChI=1S/C7H7NO2/c1-6-3-2-4-7(5-6)8(9)10/h2-5H,1H3
IUPAC name 1-methyl-3-nitro-benzene, 1-methyl-3-nitrobenzene
Molecular formula C7H7NO2
Molecular mass 137.138
Monoisotopic mass 137.04768
SMILES CC1=CC(=CC=C1)[N+](=O)[O-], Cc1cccc([N+](=O)[O-])c1

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 60175e1d-f78c-4117-aff2-67e5e962272b 3-nitrotoluene

Concept Associations

Source List Source Flow Source Context Unit Match Type Conversion Provenance
EF 3.1 3-nitrotoluene Emissions/Emissions to soil/Emissions to non-agricultural soil 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=3-nitrotoluene||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); cas=99-08-1; added Common Chemistry CAS names as altLabel: 1-Nitro-3-methylbenzene, 3-Methyl-1-nitrobenzene, 3-Methylnitrobenzene, <em>m</em>-Methylnitrobenzene, <em>m</em>-Mononitrotoluene, <em>m</em>-Nitrotoluene, Benzene, 1-methyl-3-nitro-, MNT, NSC 9578, Toluene, <em>m</em>-nitro-; object_uuid=fo-073d15102af90188
cas_match_labels 1 — consensus_match group_key=3-nitrotoluene||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'99-08-1': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-073d15102af90188: {'99-08-1': 'exactMatch'}

Context Attributes

AttributeValue
dimensionEnvironmental
mediaGround
geographyUnknown

Consensus Changes

Field Old Value New Value Comment
altLabel [{'@value': '1-methyl-3-nitrobenzene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:1-methyl-3-nitrobenzene', 'http://purl.obolibrary.org/obo/CHEBI_39931', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '3-Nitrotoluol', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:3-Nitrotoluol', 'http://purl.obolibrary.org/obo/CHEBI_39931', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'm-Nitrotoluol', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:m-Nitrotoluol', 'http://purl.obolibrary.org/obo/CHEBI_39931', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'm-methylnitrobenzene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:m-methylnitrobenzene', 'http://purl.obolibrary.org/obo/CHEBI_39931', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'm-nitrotoluene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:m-nitrotoluene', 'http://purl.obolibrary.org/obo/CHEBI_39931', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'meta-Nitrotoluol', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:meta-Nitrotoluol', 'http://purl.obolibrary.org/obo/CHEBI_39931', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}] [{'@value': '1-methyl-3-nitrobenzene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:1-methyl-3-nitrobenzene', 'http://purl.obolibrary.org/obo/CHEBI_39931', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '3-Nitrotoluol', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:3-Nitrotoluol', 'http://purl.obolibrary.org/obo/CHEBI_39931', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'm-Nitrotoluol', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:m-Nitrotoluol', 'http://purl.obolibrary.org/obo/CHEBI_39931', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'm-methylnitrobenzene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:m-methylnitrobenzene', 'http://purl.obolibrary.org/obo/CHEBI_39931', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'm-nitrotoluene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:m-nitrotoluene', 'http://purl.obolibrary.org/obo/CHEBI_39931', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'meta-Nitrotoluol', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:meta-Nitrotoluol', 'http://purl.obolibrary.org/obo/CHEBI_39931', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '1-Nitro-3-methylbenzene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:99-08-1', 'https://commonchemistry.cas.org/detail?cas_rn=99-08-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '3-Methyl-1-nitrobenzene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:99-08-1', 'https://commonchemistry.cas.org/detail?cas_rn=99-08-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '3-Methylnitrobenzene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:99-08-1', 'https://commonchemistry.cas.org/detail?cas_rn=99-08-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '<em>m</em>-Methylnitrobenzene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:99-08-1', 'https://commonchemistry.cas.org/detail?cas_rn=99-08-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '<em>m</em>-Mononitrotoluene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:99-08-1', 'https://commonchemistry.cas.org/detail?cas_rn=99-08-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '<em>m</em>-Nitrotoluene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:99-08-1', 'https://commonchemistry.cas.org/detail?cas_rn=99-08-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Benzene, 1-methyl-3-nitro-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:99-08-1', 'https://commonchemistry.cas.org/detail?cas_rn=99-08-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'MNT', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:99-08-1', 'https://commonchemistry.cas.org/detail?cas_rn=99-08-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'NSC 9578', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:99-08-1', 'https://commonchemistry.cas.org/detail?cas_rn=99-08-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Toluene, <em>m</em>-nitro-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:99-08-1', 'https://commonchemistry.cas.org/detail?cas_rn=99-08-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=3-nitrotoluene||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); cas=99-08-1; added Common Chemistry CAS names as altLabel: 1-Nitro-3-methylbenzene, 3-Methyl-1-nitrobenzene, 3-Methylnitrobenzene, <em>m</em>-Methylnitrobenzene, <em>m</em>-Mononitrotoluene, <em>m</em>-Nitrotoluene, Benzene, 1-methyl-3-nitro-, MNT, NSC 9578, Toluene, <em>m</em>-nitro-; object_uuid=fo-073d15102af90188
cas_match_labels None {'99-08-1': 'exactMatch'} group_key=3-nitrotoluene||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'99-08-1': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-073d15102af90188: {'99-08-1': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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