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2,4,6-trinitrotoluene

UUID 4d9a8790-3ddd-11dd-9cac-0050c2490048
Flow Object IDfo-7e31ade3b361a675
Source EF 3.1
Context Environmental → Ground → Unknown
CAS Numbers 118-96-7
EC Numbers 204-289-6
prefLabel
Language Value Provenance
en 2,4,6-trinitrotoluene
altLabel ⓘ
Language Value Provenance
en 1-methyl-2,4,6-trinitrobenzene
en 2,4,6-TNT
en 2,4,6-Trinitrotoluol
en 2-methyl-1,3,5-trinitrobenzene
en TNT
en Trinitrotoluen
en Trinitrotoluol
en Tritol
en Trotyl
en alpha-TNT
en s-Trinitrotoluol
en s-trinitrotoluene
en sym-Trinitrotoluol
en trinitrotoluene
en 4-Methyl-1,3,5-trinitrobenzene
en <em>sym</em>-Trinitrotoluene
en <em>sym</em>-Trinitrotoluol
en Benzene, 2-methyl-1,3,5-trinitro-
en Gradetol
en MeSH ID: D014303
en NSC 36949
en Tolit
en Tolite
en Toluene, 2,4,6-trinitro-
en Tritol (explosive)
en Trotyl oil
en α-TNT
Definitions
Language Value Provenance
en A trinitrotoluene having the nitro groups at positions 2, 4 and 6.
References
Shared Properties
Predicate Value
Formal charge 0
InChIKey SPSSULHKWOKEEL-UHFFFAOYSA-N
InChI InChI=1S/C7H5N3O6/c1-4-6(9(13)14)2-5(8(11)12)3-7(4)10(15)16/h2-3H,1H3
IUPAC name 2-methyl-1,3,5-trinitro-benzene, 2-methyl-1,3,5-trinitrobenzene
Molecular formula C7H5N3O6
Molecular mass 227.132
Monoisotopic mass 227.01783
SMILES CC1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-], Cc1c([N+](=O)[O-])cc([N+](=O)[O-])cc1[N+](=O)[O-]

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 4d9a8790-3ddd-11dd-9cac-0050c2490048 2,4,6-trinitrotoluene

Concept Associations

Source List Source Flow Source Context Unit Match Type Conversion Provenance
EF 3.1 2,4,6-trinitrotoluene Emissions/Emissions to soil/Emissions to soil, 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=2,4,6-trinitrotoluene||dimension=Environmental > media=Air > indoor=Unknown; cas=118-96-7; added Common Chemistry CAS names as altLabel: 4-Methyl-1,3,5-trinitrobenzene, <em>sym</em>-Trinitrotoluene, <em>sym</em>-Trinitrotoluol, Benzene, 2-methyl-1,3,5-trinitro-, Gradetol, MeSH ID: D014303, NSC 36949, Tolit, Tolite, Toluene, 2,4,6-trinitro-, Tritol (explosive), Trotyl oil, α-TNT; object_uuid=fo-7e31ade3b361a675
cas_match_labels 1 — consensus_match group_key=2,4,6-trinitrotoluene||dimension=Environmental > media=Air > indoor=Unknown; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'118-96-7': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-7e31ade3b361a675: {'118-96-7': 'exactMatch'}

Context Attributes

AttributeValue
dimensionEnvironmental
mediaGround
geographyUnknown

Consensus Changes

Field Old Value New Value Comment
altLabel [{'@value': '1-methyl-2,4,6-trinitrobenzene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:1-methyl-2,4,6-trinitrobenzene', 'http://purl.obolibrary.org/obo/CHEBI_46053', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '2,4,6-TNT', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:2,4,6-TNT', 'http://purl.obolibrary.org/obo/CHEBI_46053', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '2,4,6-Trinitrotoluol', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:2,4,6-Trinitrotoluol', 'http://purl.obolibrary.org/obo/CHEBI_46053', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '2-methyl-1,3,5-trinitrobenzene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:2-methyl-1,3,5-trinitrobenzene', 'http://purl.obolibrary.org/obo/CHEBI_46053', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'TNT', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:TNT', 'http://purl.obolibrary.org/obo/CHEBI_46053', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Trinitrotoluen', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Trinitrotoluen', 'http://purl.obolibrary.org/obo/CHEBI_46053', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Trinitrotoluol', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Trinitrotoluol', 'http://purl.obolibrary.org/obo/CHEBI_46053', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Tritol', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Tritol', 'http://purl.obolibrary.org/obo/CHEBI_46053', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Trotyl', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Trotyl', 'http://purl.obolibrary.org/obo/CHEBI_46053', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'alpha-TNT', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:alpha-TNT', 'http://purl.obolibrary.org/obo/CHEBI_46053', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 's-Trinitrotoluol', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:s-Trinitrotoluol', 'http://purl.obolibrary.org/obo/CHEBI_46053', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 's-trinitrotoluene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:s-trinitrotoluene', 'http://purl.obolibrary.org/obo/CHEBI_46053', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'sym-Trinitrotoluol', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:sym-Trinitrotoluol', 'http://purl.obolibrary.org/obo/CHEBI_46053', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'trinitrotoluene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:trinitrotoluene', 'http://purl.obolibrary.org/obo/CHEBI_46053', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}] [{'@value': '1-methyl-2,4,6-trinitrobenzene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:1-methyl-2,4,6-trinitrobenzene', 'http://purl.obolibrary.org/obo/CHEBI_46053', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '2,4,6-TNT', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:2,4,6-TNT', 'http://purl.obolibrary.org/obo/CHEBI_46053', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '2,4,6-Trinitrotoluol', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:2,4,6-Trinitrotoluol', 'http://purl.obolibrary.org/obo/CHEBI_46053', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '2-methyl-1,3,5-trinitrobenzene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:2-methyl-1,3,5-trinitrobenzene', 'http://purl.obolibrary.org/obo/CHEBI_46053', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'TNT', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:TNT', 'http://purl.obolibrary.org/obo/CHEBI_46053', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Trinitrotoluen', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Trinitrotoluen', 'http://purl.obolibrary.org/obo/CHEBI_46053', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Trinitrotoluol', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Trinitrotoluol', 'http://purl.obolibrary.org/obo/CHEBI_46053', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Tritol', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Tritol', 'http://purl.obolibrary.org/obo/CHEBI_46053', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Trotyl', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Trotyl', 'http://purl.obolibrary.org/obo/CHEBI_46053', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'alpha-TNT', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:alpha-TNT', 'http://purl.obolibrary.org/obo/CHEBI_46053', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 's-Trinitrotoluol', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:s-Trinitrotoluol', 'http://purl.obolibrary.org/obo/CHEBI_46053', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 's-trinitrotoluene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:s-trinitrotoluene', 'http://purl.obolibrary.org/obo/CHEBI_46053', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'sym-Trinitrotoluol', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:sym-Trinitrotoluol', 'http://purl.obolibrary.org/obo/CHEBI_46053', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'trinitrotoluene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:trinitrotoluene', 'http://purl.obolibrary.org/obo/CHEBI_46053', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '4-Methyl-1,3,5-trinitrobenzene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:118-96-7', 'https://commonchemistry.cas.org/detail?cas_rn=118-96-7'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '<em>sym</em>-Trinitrotoluene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:118-96-7', 'https://commonchemistry.cas.org/detail?cas_rn=118-96-7'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '<em>sym</em>-Trinitrotoluol', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:118-96-7', 'https://commonchemistry.cas.org/detail?cas_rn=118-96-7'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Benzene, 2-methyl-1,3,5-trinitro-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:118-96-7', 'https://commonchemistry.cas.org/detail?cas_rn=118-96-7'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Gradetol', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:118-96-7', 'https://commonchemistry.cas.org/detail?cas_rn=118-96-7'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'MeSH ID: D014303', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:118-96-7', 'https://commonchemistry.cas.org/detail?cas_rn=118-96-7'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'NSC 36949', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:118-96-7', 'https://commonchemistry.cas.org/detail?cas_rn=118-96-7'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Tolit', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:118-96-7', 'https://commonchemistry.cas.org/detail?cas_rn=118-96-7'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Tolite', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:118-96-7', 'https://commonchemistry.cas.org/detail?cas_rn=118-96-7'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Toluene, 2,4,6-trinitro-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:118-96-7', 'https://commonchemistry.cas.org/detail?cas_rn=118-96-7'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Tritol (explosive)', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:118-96-7', 'https://commonchemistry.cas.org/detail?cas_rn=118-96-7'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Trotyl oil', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:118-96-7', 'https://commonchemistry.cas.org/detail?cas_rn=118-96-7'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'α-TNT', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:118-96-7', 'https://commonchemistry.cas.org/detail?cas_rn=118-96-7'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=2,4,6-trinitrotoluene||dimension=Environmental > media=Air > indoor=Unknown; cas=118-96-7; added Common Chemistry CAS names as altLabel: 4-Methyl-1,3,5-trinitrobenzene, <em>sym</em>-Trinitrotoluene, <em>sym</em>-Trinitrotoluol, Benzene, 2-methyl-1,3,5-trinitro-, Gradetol, MeSH ID: D014303, NSC 36949, Tolit, Tolite, Toluene, 2,4,6-trinitro-, Tritol (explosive), Trotyl oil, α-TNT; object_uuid=fo-7e31ade3b361a675
cas_match_labels None {'118-96-7': 'exactMatch'} group_key=2,4,6-trinitrotoluene||dimension=Environmental > media=Air > indoor=Unknown; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'118-96-7': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-7e31ade3b361a675: {'118-96-7': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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  "name": null,
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    "media": "Ground",
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  "general_comment": null,
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  "unit": "kg",
  "lcia_methods": [
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  "source": "EF 3.1",
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