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2,5-Diaminotoluene

UUID c3fe0b32-b557-46ef-96cd-48f485c18b34
Deprecated yes
Replaced By 90436e50-5447-49ce-a128-726f3aff814e
Flow Object IDfo-fce8ee99fe45ac87
Source EF 3.1
Context Environmental → Water → Unknown
CAS Numbers 95-70-5
EC Numbers 202-442-1
prefLabel
Language Value Provenance
en 2,5-Diaminotoluene
altLabel ⓘ
Language Value Provenance
en 1-methyl-2,5-diaminobenzene
en 2,5-Toluenediamine
en 2,5-diamino-1-methylbenzene
en 2-Methyl-1,4-benzenediamine
en 2-methylbenzene-1,4-diamine
en 4-Amino-2-methylaniline
en p-Toluenediamine
en toluene-2,5-diamine
en 1,4-Benzenediamine, 2-methyl-
en 1,4-Diamino-2-methylbenzene
en 2,5-Diaminotoluol
en 2-Methyl-1,4-phenylenediamine
en 2-Methyl-<em>p</em>-phenylenediamine
en 4-Amino-3-methylaniline
en <em>p</em>-Toluenediamine
en C.I. 76042
en Toluylene-2,5-diamine
en 2-methyl-p-phenylenediamine
Definitions
Language Value Provenance
en A diamine in which the two amino groups are substituted into toluene at the 2- and 5-positions.
References
Shared Properties
Predicate Value
Formal charge 0
InChIKey OBCSAIDCZQSFQH-UHFFFAOYSA-N
InChI InChI=1S/C7H10N2/c1-5-4-6(8)2-3-7(5)9/h2-4H,8-9H2,1H3
IUPAC name (4-amino-2-methyl-phenyl)amine, 2-methylbenzene-1,4-diamine
Molecular formula C7H10N2
Molecular mass 122.171
Monoisotopic mass 122.0844
SMILES CC1=C(C=CC(=C1)N)N, Cc1cc(N)ccc1N

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 c3fe0b32-b557-46ef-96cd-48f485c18b34 2-methyl-p-phenylenediamine

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-methyl-p-phenylenediamine||dimension=Environmental > media=Air > strata=Unknown; cas=95-70-5; added Common Chemistry CAS names as altLabel: 1,4-Benzenediamine, 2-methyl-, 1,4-Diamino-2-methylbenzene, 2,5-Diaminotoluol, 2-Methyl-1,4-phenylenediamine, 2-Methyl-<em>p</em>-phenylenediamine, 4-Amino-3-methylaniline, <em>p</em>-Toluenediamine, C.I. 76042, Toluylene-2,5-diamine; object_uuid=fo-fce8ee99fe45ac87
cas_match_labels 1 — consensus_match group_key=2-methyl-p-phenylenediamine||dimension=Environmental > media=Air > strata=Unknown; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'95-70-5': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-fce8ee99fe45ac87: {'95-70-5': 'exactMatch'}

Context Attributes

AttributeValue
dimensionEnvironmental
mediaWater
water_bodyUnknown

Consensus Changes

Field Old Value New Value Comment
altLabel [{'@value': '1-methyl-2,5-diaminobenzene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:1-methyl-2,5-diaminobenzene', 'http://purl.obolibrary.org/obo/CHEBI_53619', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '2,5-Diaminotoluene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:2,5-Diaminotoluene', 'http://purl.obolibrary.org/obo/CHEBI_53619', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '2,5-Toluenediamine', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:2,5-Toluenediamine', 'http://purl.obolibrary.org/obo/CHEBI_53619', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '2,5-diamino-1-methylbenzene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:2,5-diamino-1-methylbenzene', 'http://purl.obolibrary.org/obo/CHEBI_53619', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '2-Methyl-1,4-benzenediamine', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:2-Methyl-1,4-benzenediamine', 'http://purl.obolibrary.org/obo/CHEBI_53619', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '2-methylbenzene-1,4-diamine', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:2-methylbenzene-1,4-diamine', 'http://purl.obolibrary.org/obo/CHEBI_53619', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '4-Amino-2-methylaniline', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:4-Amino-2-methylaniline', 'http://purl.obolibrary.org/obo/CHEBI_53619', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'p-Toluenediamine', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:p-Toluenediamine', 'http://purl.obolibrary.org/obo/CHEBI_53619', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'toluene-2,5-diamine', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:toluene-2,5-diamine', 'http://purl.obolibrary.org/obo/CHEBI_53619', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}] [{'@value': '1-methyl-2,5-diaminobenzene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:1-methyl-2,5-diaminobenzene', 'http://purl.obolibrary.org/obo/CHEBI_53619', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '2,5-Diaminotoluene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:2,5-Diaminotoluene', 'http://purl.obolibrary.org/obo/CHEBI_53619', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '2,5-Toluenediamine', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:2,5-Toluenediamine', 'http://purl.obolibrary.org/obo/CHEBI_53619', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '2,5-diamino-1-methylbenzene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:2,5-diamino-1-methylbenzene', 'http://purl.obolibrary.org/obo/CHEBI_53619', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '2-Methyl-1,4-benzenediamine', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:2-Methyl-1,4-benzenediamine', 'http://purl.obolibrary.org/obo/CHEBI_53619', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '2-methylbenzene-1,4-diamine', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:2-methylbenzene-1,4-diamine', 'http://purl.obolibrary.org/obo/CHEBI_53619', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '4-Amino-2-methylaniline', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:4-Amino-2-methylaniline', 'http://purl.obolibrary.org/obo/CHEBI_53619', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'p-Toluenediamine', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:p-Toluenediamine', 'http://purl.obolibrary.org/obo/CHEBI_53619', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'toluene-2,5-diamine', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:toluene-2,5-diamine', 'http://purl.obolibrary.org/obo/CHEBI_53619', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '1,4-Benzenediamine, 2-methyl-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:95-70-5', 'https://commonchemistry.cas.org/detail?cas_rn=95-70-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '1,4-Diamino-2-methylbenzene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:95-70-5', 'https://commonchemistry.cas.org/detail?cas_rn=95-70-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '2,5-Diaminotoluol', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:95-70-5', 'https://commonchemistry.cas.org/detail?cas_rn=95-70-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '2-Methyl-1,4-phenylenediamine', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:95-70-5', 'https://commonchemistry.cas.org/detail?cas_rn=95-70-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '2-Methyl-<em>p</em>-phenylenediamine', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:95-70-5', 'https://commonchemistry.cas.org/detail?cas_rn=95-70-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '4-Amino-3-methylaniline', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:95-70-5', 'https://commonchemistry.cas.org/detail?cas_rn=95-70-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '<em>p</em>-Toluenediamine', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:95-70-5', 'https://commonchemistry.cas.org/detail?cas_rn=95-70-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'C.I. 76042', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:95-70-5', 'https://commonchemistry.cas.org/detail?cas_rn=95-70-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Toluylene-2,5-diamine', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:95-70-5', 'https://commonchemistry.cas.org/detail?cas_rn=95-70-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=2-methyl-p-phenylenediamine||dimension=Environmental > media=Air > strata=Unknown; cas=95-70-5; added Common Chemistry CAS names as altLabel: 1,4-Benzenediamine, 2-methyl-, 1,4-Diamino-2-methylbenzene, 2,5-Diaminotoluol, 2-Methyl-1,4-phenylenediamine, 2-Methyl-<em>p</em>-phenylenediamine, 4-Amino-3-methylaniline, <em>p</em>-Toluenediamine, C.I. 76042, Toluylene-2,5-diamine; object_uuid=fo-fce8ee99fe45ac87
cas_match_labels None {'95-70-5': 'exactMatch'} group_key=2-methyl-p-phenylenediamine||dimension=Environmental > media=Air > strata=Unknown; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'95-70-5': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-fce8ee99fe45ac87: {'95-70-5': '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": "Water",
    "water_body": "Unknown"
  },
  "general_comment": "Correct mapping CAS and flow to be verified: yet unclear whether this is the sodium-, hydrochloride-, calcium-, potassium- or other salt or the pure substance that is emitted. Note that the CAS No is the relevant identifier, to which also the ILCD LCIA characterisation factors relate. Reference elementary flow of the International Reference Life Cycle Data System (ILCD).",
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