Consensus flow list

Identity

Type
Neutral molecule
CAS
88-74-4
EC
201-855-4
Origin
EF 3.1 hybrid_name_cas_v1
Changes
55 across every transformer

Structure

Structure diagram for 2-nitroaniline

Alternative labels

34

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string DPJCXCZTLWNFOH-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C6H6N2O2/c7-5-3-1-2-4-6(5)8(9)10/h1-4H,7H2
IUPAC name chemrof:IUPAC_name 2-nitroaniline
Molecular formula chemrof:molecular_formula C6H6N2O2
Molecular mass chemrof:molecular_mass 138.126
Monoisotopic mass chemrof:monoisotopic_mass 138.042927
SMILES string chemrof:smiles_string Nc1ccccc1[N+](=O)[O-]

Known URLs

14

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=88-74-4 enrich_references.consensus_cas_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.001.687 enrich_references.pubchem_identifier_url
chemicalsafety.ilo.org https://chemicalsafety.ilo.org/dyn/icsc/showcard.display?p_card_id=0306 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID1025726 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=9796 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL274009 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/2519U0541L enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J3.908J enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J812.451E enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/6946 enrich_references.pubchem_compound
PubChem https://pubchem.ncbi.nlm.nih.gov/erg/#1661 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/substance/?source=niaid&sourceid=019456 enrich_references.pubchem_identifier_url
wikidata.org https://www.wikidata.org/wiki/Q2590230 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/2-Nitroaniline enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
fec7fda3-1226-4aad-bda7-87b0ecff545b Environmental → Air → Aircraft cruise height EF 3.1 kg 4
59f39678-fa5c-4591-bb14-ed66054401c4 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
451e0c8d-a48b-425a-9356-b8443ce67d20 Environmental → Air → Indoor EF 3.1 kg 4
e1e3588a-dc99-4ffd-83b4-d34439cf18e6 Environmental → Air → Long-term EF 3.1 kg 0
7b998c12-bb59-44b3-849c-f6296857a9c6 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
117e10fb-32d3-4f4d-93ad-6cacc318d0fe Environmental → Air → Unknown EF 3.1 kg 4
68056a34-f1dc-4307-abc8-ecf5355359f0 Environmental → Ground → Agricultural EF 3.1 kg 4
c3a3939b-a372-419e-940a-ff765b3db2ea Environmental → Ground → Non-agricultural EF 3.1 kg 4
1248253f-1427-45d1-895b-923afc21e728 Environmental → Ground → Unknown EF 3.1 kg 4
6bf51a03-a54d-4b1f-a617-4502147b749c Environmental → Water → Long-term EF 3.1 kg 0
589dcb71-d02e-4f21-affa-faaa9b59676d Environmental → Water → Ocean EF 3.1 kg 4
1eadc679-3835-4063-9409-f9cc99b9d5c5 Environmental → Water → Surface water EF 3.1 kg 4
ffd95175-6ad0-4e3e-ad4b-fb4d820ec2c8 Environmental → Water → Unknown EF 3.1 kg 4

History

Everything that changed this substance (55 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-983b29f2b09f939c",
  "prefLabel": [
    {
      "@value": "2-nitroaniline",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
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        ],
        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "1-Amino-2-nitrobenzene",
      "@language": "en",
      "@lang": "en",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "1-Nitro-2-aminobenzene",
      "@language": "en",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "2-Aminonitrobenzene",
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      }
    },
    {
      "@value": "2-Nitrobenzenamine",
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    },
    {
      "@value": "2-Nitrophenylamine",
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    },
    {
      "@value": "Aniline, o-nitro-",
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      "@value": "Devol Orange Salt B",
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    },
    {
      "@value": "Fast Orange O Base",
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    },
    {
      "@value": "Fast Orange O Salt",
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    {
      "@value": "Hiltonil Fast Orange GR Base",
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    },
    {
      "@value": "Hiltosal Fast Orange GR Salt",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Hindasol Orange GR Salt",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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      }
    },
    {
      "@value": "Natasol Fast Orange GR Salt",
      "@language": "en",
      "@lang": "en",
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        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "o-Aminonitrobenzene",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:wasAttributedTo": "consensus-flow-list",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "o-Nitroaniline",
      "@language": "en",
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      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "o-Nitrobenzenamine",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:wasAttributedTo": "consensus-flow-list",
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          "https://commonchemistry.cas.org/detail?cas_rn=88-74-4"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "o-Nitrophenylamine",
      "@language": "en",
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      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "ONA",
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      }
    },
    {
      "@value": "Orange Base Ciba II",
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      }
    },
    {
      "@value": "Orange Base Irga II",
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      }
    },
    {
      "@value": "Orange GRS Salt",
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    },
    {
      "@value": "Orange Salt Ciba II",
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    },
    {
      "@value": "Orange Salt Irga II",
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  ],
  "properties": {
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      "@id": "https://w3id.org/chemrof/molecular_formula",
      "@value": [
        "C6H6N2O2"
      ],
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          "prov:hadPrimarySource": [
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      ]
    },
    "https://w3id.org/chemrof/inchi2d_key_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_key_string",
      "@value": [
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      ],
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      "rdfs:label": "InChIKey",
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