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2,6-dichloroanisole

fo-179a89d4838ff696

Identity

Type
Neutral molecule
CAS
1984-65-2
EC
217-855-2
Origin
EF 3.1 hybrid_name_cas_v1
Changes
54 across every transformer

Structure

Structure diagram for 2,6-dichloroanisole

Alternative labels

5

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string KZLMCDNAVVJKPX-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C7H6Cl2O/c1-10-7-5(8)3-2-4-6(7)9/h2-4H,1H3
IUPAC name chemrof:IUPAC_name 2,6-dichloroanisole
Molecular formula chemrof:molecular_formula C7H6Cl2O
Molecular mass chemrof:molecular_mass 177.03
Monoisotopic mass chemrof:monoisotopic_mass 175.97957
SMILES string chemrof:smiles_string COc1c(Cl)cccc1Cl

Known URLs

6

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=1984-65-2 enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.016.233 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID1062097 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J149.834G enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/16127 enrich_references.pubchem_compound
Wikidata https://www.wikidata.org/wiki/Q72465412 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
d0014d5b-5d12-4840-a240-ca475b130dc3 Environmental → Air → Aircraft cruise height EF 3.1 kg 2
aba4678b-2e70-4d4a-9653-0e3ff0c9974d Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
4df0b732-5bf1-4b80-8fa4-caabf525c512 Environmental → Air → Indoor EF 3.1 kg 2
b69c0cc9-4f6a-4ce0-bd95-c225702dd7a2 Environmental → Air → Long-term EF 3.1 kg 0
9d369d60-a375-4b7b-aa75-83084b2bdabf Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
0a0bbf60-f8e3-4c93-b02f-e4783244ec8b Environmental → Air → Unknown EF 3.1 kg 2
d894af1a-f6e4-42b8-b1c9-dbc29e2dd131 Environmental → Ground → Agricultural EF 3.1 kg 2
b29d3b1d-adbe-409c-85cf-dfd74376c437 Environmental → Ground → Non-agricultural EF 3.1 kg 2
1fb0a109-7585-45e4-86d4-16bbf0f7500d Environmental → Ground → Unknown EF 3.1 kg 2
5fb28206-0f6f-4d2b-b828-faec6fe6d826 Environmental → Water → Long-term EF 3.1 kg 0
5774ce1a-1829-4399-9780-5650338ca9cf Environmental → Water → Ocean EF 3.1 kg 2
42b9257f-7b68-403f-8934-e08233f94446 Environmental → Water → Surface water EF 3.1 kg 2
6de2ffd1-ca16-43ca-9a30-fc340c8f7eb6 Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (54 changes)

Open the changes page

Full record

Flow object JSON 
{
  "flow_object_id": "fo-179a89d4838ff696",
  "prefLabel": [
    {
      "@value": "2,6-dichloroanisole",
      "@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": "1,3-Dichloro-2-methoxybenzene",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
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          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=1984-65-2"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "2,6-Dichloranisole",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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          "https://commonchemistry.cas.org/detail?cas_rn=1984-65-2"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "2,6-Dichlorophenyl methyl ether",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:wasAttributedTo": "consensus-flow-list",
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          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=1984-65-2"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Anisole, 2,6-dichloro-",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Benzene, 1,3-dichloro-2-methoxy-",
      "@language": "en",
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      "provenance": {
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    },
    "https://w3id.org/chemrof/smiles_string": {
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        {
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      "attested_by": {
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    },
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      "rdfs:label": "IUPAC name",
      "@value": [
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      ],
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    "https://w3id.org/chemrof/molecular_mass": {
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        },
        {
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      },
      "http://qudt.org/schema/qudt/hasUnit": "https://vocab.brightway.one/units/unit/GM-PER-MOL"
    },
    "https://w3id.org/chemrof/monoisotopic_mass": {
      "@id": "https://w3id.org/chemrof/monoisotopic_mass",
      "rdfs:label": "Monoisotopic mass",
      "@value": [
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      ],
      "provenance": [
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      ],
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      },
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    }
  },
  "references": [
    {
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  ],
  "created_from": {
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    "seed_uuid": "0a0bbf60-f8e3-4c93-b02f-e4783244ec8b",
    "seed_source": "EF 3.1",
    "semantic_typing": {
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      "reason": "",
      "types": [
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      ],
      "provenance": {
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  },
  "classifications": {
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  "origin_qualifier": null,
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  "@type": [
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}

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