Consensus flow list

Identity

Type
Neutral molecule
CAS
119-93-7
EC
204-358-0
Origin
EF 3.1 hybrid_name_cas_v1
Changes
56 across every transformer

Structure

Structure diagram for 4,4'-bi-o-toluidine

Alternative labels

17

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string NUIURNJTPRWVAP-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C14H16N2/c1-9-7-11(3-5-13(9)15)12-4-6-14(16)10(2)8-12/h3-8H,15-16H2,1-2H3
IUPAC name chemrof:IUPAC_name 3,3'-Dimethyl-4,4'-diaminobiphenyl
Molecular formula chemrof:molecular_formula C14H16N2
Molecular mass chemrof:molecular_mass 212.296
Monoisotopic mass chemrof:monoisotopic_mass 212.131349, 212.13135
SMILES string chemrof:smiles_string Cc1cc(-c2ccc(N)c(C)c2)ccc1N

Known URLs

16

Where else this substance is described. Collected while the pipeline resolved it — from ChEBI's cross-references, from PubChem's identifier list, and from the CAS number — so a link here is a record the merge actually read, not a search it suggests.

Resource URL Recorded by
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=119-93-7 enrich_references.chebi_xrefs
cdc.gov https://www.cdc.gov/niosh-rtecs/DD12B128.html enrich_references.pubchem_identifier_url
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:34320 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.003.962 enrich_references.pubchem_identifier_url
chemicalsafety.ilo.org https://chemicalsafety.ilo.org/dyn/icsc/showcard.display?p_card_id=0960 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID5024059 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL85109 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/63HLO2IV6K enrich_references.pubchem_identifier_url
HMDB https://hmdb.ca/metabolites/HMDB0255871 enrich_references.pubchem_identifier_url
hts.usitc.gov https://hts.usitc.gov/search?query=2921.59.08.00 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J1.189D enrich_references.pubchem_identifier_url
KEGG https://www.genome.jp/entry/C14443 enrich_references.chebi_xrefs
kegg.jp https://www.kegg.jp/entry/C14443 enrich_references.pubchem_identifier_url
ncithesaurus.nci.nih.gov https://ncithesaurus.nci.nih.gov/ncitbrowser/ConceptReport.jsp?dictionary=NCI_Thesaurus&ns=ncit&code=C44428 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/8413 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q413500 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
b0e6e2c4-1b55-428e-9fa3-59c51487221f Environmental → Air → Aircraft cruise height EF 3.1 kg 2
c1e8395c-8386-4210-8676-10c00b924017 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
e3e84de7-2512-4065-87df-a7638220dcdb Environmental → Air → Indoor EF 3.1 kg 2
f9604a49-698b-4de2-b21b-812641164802 Environmental → Air → Long-term EF 3.1 kg 0
e8935250-049b-4f85-aee1-0597f1aecb29 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
1bd44707-e103-4342-859a-16781c6d97a3 Environmental → Air → Unknown EF 3.1 kg 2
fabd5dc4-91a8-4035-a60c-66e2b25ff7d2 Environmental → Ground → Agricultural EF 3.1 kg 2
5cb16a15-c5f2-4356-9bd2-616bfa9c5637 Environmental → Ground → Non-agricultural EF 3.1 kg 2
79179a5c-9837-47f2-9f6e-3d4cd287092a Environmental → Ground → Unknown EF 3.1 kg 2
4f7c7e06-7bc5-407f-af44-5203c9c3d2b9 Environmental → Water → Long-term EF 3.1 kg 0
73cd8edc-3f7f-4421-8ac0-e65bf8a873bb Environmental → Water → Ocean EF 3.1 kg 2
ee2de936-3048-4ed7-8b5a-ae71d75ad145 Environmental → Water → Surface water EF 3.1 kg 2
d72b617b-c1e8-4c84-be80-4385d4d52b5b Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (56 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-171e0059bf8a605b",
  "prefLabel": [
    {
      "@value": "4,4'-bi-o-toluidine",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "3,3'-Dimethyl-4,4'-diaminobiphenyl",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "3,3'-Dimethylbenzidine",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:wasAttributedTo": "consensus-flow-list",
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        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "3,3′-Dimethyl-4,4′-biphenyldiamine",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "3,3′-Dimethyl-4,4′-diaminobiphenyl",
      "@language": "en",
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      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "3,3′-Dimethyl[1,1′-biphenyl]-4,4′-diamine",
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      "@lang": "en",
      "provenance": {
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    },
    {
      "@value": "3,3′-Dimethylbenzidine",
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      }
    },
    {
      "@value": "3,3′-Tolidine",
      "@language": "en",
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    },
    {
      "@value": "4,4′-Diamino-3,3′-dimethyl-1,1′-biphenyl",
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    },
    {
      "@value": "4,4′-Diamino-3,3′-dimethylbiphenyl",
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    {
      "@value": "4,4′-Diamino-3,3′-methyl-1,1′-biphenyl",
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      }
    },
    {
      "@value": "4′-Amino-3,3′-dimethyl[1,1′-biphenyl]-4-ylamine",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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    },
    {
      "@value": "[1,1′-Biphenyl]-4,4′-diamine, 3,3′-dimethyl-",
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    },
    {
      "@value": "Benzidine, 3,3′-dimethyl-",
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    },
    {
      "@value": "C.I. Azoic Diazo Component 113",
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    },
    {
      "@value": "Fast Dark Blue Base R",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "o,o′-Tolidine",
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        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "o-Tolidine",
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  ],
  "properties": {
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  "references": [
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