Brightway Flows 1.0
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O-anisidine

fo-65c9fa025f709a03

Identity

Type
Neutral molecule
CAS
90-04-0
EC
201-963-1
Origin
EF 3.1 hybrid_name_cas_v1
Changes
57 across every transformer

Structure

Structure diagram for O-anisidine

Alternative labels

17

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string VMPITZXILSNTON-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C7H9NO/c1-9-7-5-3-2-4-6(7)8/h2-5H,8H2,1H3
IUPAC name chemrof:IUPAC_name 1-amino-2-methoxybenzene
Molecular formula chemrof:molecular_formula C7H9NO
Molecular mass chemrof:molecular_mass 123.155
Monoisotopic mass chemrof:monoisotopic_mass 123.06841, 123.068414
SMILES string chemrof:smiles_string COc1ccccc1N

Known URLs

23

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
beilstein beilstein:386210 enrich_references.chebi_xrefs
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=90-04-0 enrich_references.chebi_xrefs
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=99742-70-8 enrich_references.pubchem_identifier_url
cdc.gov https://www.cdc.gov/niosh-rtecs/BZ528CD0.html enrich_references.pubchem_identifier_url
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:82288 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.001.785 enrich_references.pubchem_identifier_url
chemicalsafety.ilo.org https://chemicalsafety.ilo.org/dyn/icsc/showcard.display?p_card_id=0970 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID5023877 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=3122 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL1612004 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/NUX042F201 enrich_references.pubchem_identifier_url
HMDB https://hmdb.ca/metabolites/HMDB0255842 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J3.551C enrich_references.pubchem_identifier_url
KEGG https://www.genome.jp/entry/C19191 enrich_references.chebi_xrefs
kegg.jp https://www.kegg.jp/entry/C19191 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/7000 enrich_references.pubchem_compound
PubChem https://pubchem.ncbi.nlm.nih.gov/erg/#2431 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/substance/?source=niaid&sourceid=019932 enrich_references.pubchem_identifier_url
PubMed https://pubmed.ncbi.nlm.nih.gov/21187827 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/22403159 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/28089782 enrich_references.chebi_xrefs
Wikidata https://www.wikidata.org/wiki/Q3295808 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/O-Anisidine enrich_references.chebi_xrefs

Elementary flows

13
Flow Context Source Unit CFs
08de6743-946f-41e4-be53-adc144d7c167 Environmental → Air → Aircraft cruise height EF 3.1 kg 4
1030d4bb-9b46-4d54-886e-378da46a8251 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
1c5f8de6-693f-4393-b555-487a12db3a58 Environmental → Air → Indoor EF 3.1 kg 4
170ecbe4-1433-4e12-96e9-b13362d96936 Environmental → Air → Long-term EF 3.1 kg 0
a133a567-9a59-4cfe-a8d4-c9ad2ea07cf8 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
5b0d33c5-3681-4834-bb39-e85303732455 Environmental → Air → Unknown EF 3.1 kg 4
4f7c9b89-80a8-422b-ab1f-c2afc5ee0cc3 Environmental → Ground → Agricultural EF 3.1 kg 4
a6bcbdf0-8f09-446f-818b-93b9a8766573 Environmental → Ground → Non-agricultural EF 3.1 kg 4
d6ed462d-45f4-4937-ad94-6dcd72c5b396 Environmental → Ground → Unknown EF 3.1 kg 4
8a0918f1-4154-4ddb-a745-acad24b117c5 Environmental → Water → Long-term EF 3.1 kg 0
ec10f5c5-f29e-4302-adfd-dc33ce58ae17 Environmental → Water → Ocean EF 3.1 kg 4
ce145902-3be3-4313-be92-8aaff9a524c4 Environmental → Water → Surface water EF 3.1 kg 4
ae4ee041-b3f0-4f91-9401-78a90eb781c8 Environmental → Water → Unknown EF 3.1 kg 4

History

Everything that changed this substance (57 changes)

Open the changes page

Full record

Flow object JSON 
{
  "flow_object_id": "fo-65c9fa025f709a03",
  "prefLabel": [
    {
      "@value": "O-anisidine",
      "@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": "1-amino-2-methoxybenzene",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "2-aminoanisole",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "chebi_altlabels",
        "prov:wasAttributedTo": "consensus-flow-list",
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        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "2-Aminomethoxybenzene",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "2-anisidine",
      "@language": "en",
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      "provenance": {
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        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "2-methoxy-1-aminobenzene",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:wasAttributedTo": "consensus-flow-list",
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        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "2-methoxyaniline",
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        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "2-methoxybenzenamine",
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    },
    {
      "@value": "2-Methoxyphenylamine",
      "@language": "en",
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      "provenance": {
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        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Benzenamine, 2-methoxy-",
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        "prov:wasDerivedFrom": "common chemistry CAS lookup"
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    },
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    },
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "o-anisylamine",
      "@language": "en",
      "@lang": "en",
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    },
    {
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    },
    {
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      }
    },
    {
      "@value": "ortho-aminoanisole",
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  "properties": {
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      "attested_by": {
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      "rdfs:label": "InChI",
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  "references": [
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