Consensus flow list

Identity

Type
Neutral molecule
CAS
582-17-2
EC
209-478-7
Origin
EF 3.1 hybrid_name_cas_v1
Changes
56 across every transformer

Structure

Structure diagram for Naphthalene-2,7-diol

Alternative labels

4

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string DFQICHCWIIJABH-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C10H8O2/c11-9-3-1-7-2-4-10(12)6-8(7)5-9/h1-6,11-12H
IUPAC name chemrof:IUPAC_name Naphthalene-2,7-diol
Molecular formula chemrof:molecular_formula C10H8O2
Molecular mass chemrof:molecular_mass 160.172
Monoisotopic mass chemrof:monoisotopic_mass 160.052429
SMILES string chemrof:smiles_string Oc1ccc2ccc(O)cc2c1

Known URLs

11

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=147398-48-9 enrich_references.pubchem_identifier_url
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=582-17-2 enrich_references.consensus_cas_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.008.618 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID2060387 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=407541 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL205165 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/0TO8E448UD enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J70.178E enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/11397 enrich_references.pubchem_compound
PubChem https://pubchem.ncbi.nlm.nih.gov/substance/?source=niaid&sourceid=017777 enrich_references.pubchem_identifier_url
wikidata.org https://www.wikidata.org/wiki/Q27237248 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
f1c2cc31-6262-4211-84cc-86715027ecd7 Environmental → Air → Aircraft cruise height EF 3.1 kg 2
86269903-361f-4f1d-88a8-89019db68fab Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
91176211-e35a-44aa-a622-c0db09a0fa76 Environmental → Air → Indoor EF 3.1 kg 2
f239c1e8-82a3-4f4a-852e-4509fb2e2ec3 Environmental → Air → Long-term EF 3.1 kg 0
b7a8f3f1-89d4-41f6-8184-16452eb5e755 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
96344250-da5d-4fb8-99dc-a44149af66b0 Environmental → Air → Unknown EF 3.1 kg 2
53756ee8-9327-4a58-92d9-ab1c28ff654b Environmental → Ground → Agricultural EF 3.1 kg 2
7b992bc2-e886-4d53-adf2-ff75509c2c1a Environmental → Ground → Non-agricultural EF 3.1 kg 2
8a7a6a99-e0b7-426e-9944-6689b11be93f Environmental → Ground → Unknown EF 3.1 kg 2
7d0d2af9-0c47-4f66-be52-0a5b7d99e4b9 Environmental → Water → Long-term EF 3.1 kg 0
2e5b7156-e637-4a19-a6ba-04b8dfa2093e Environmental → Water → Ocean EF 3.1 kg 2
0d7cc87a-b549-45c5-a219-c290add9aa0b Environmental → Water → Surface water EF 3.1 kg 2
ac990a59-0ea6-457a-8b05-3e70541e45c7 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-5e00ef3fefcb7450",
  "prefLabel": [
    {
      "@value": "Naphthalene-2,7-diol",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "bootstrap_labels",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "2,7-Dihydroxynaphthalene",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:582-17-2",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=582-17-2"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "2,7-Naphthalenediol",
      "@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=582-17-2"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "2,7-Naphthohydroquinone",
      "@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=582-17-2"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "7-Hydroxy-2-naphthol",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
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  ],
  "properties": {
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      "rdfs:label": "Molecular formula",
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    },
    "https://w3id.org/chemrof/smiles_string": {
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    },
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      ],
      "attested_by": {
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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": {
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      "rdfs:label": "Monoisotopic mass",
      "@value": [
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      ],
      "attested_by": {
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      },
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  },
  "references": [
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  "created_from": {
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  "@type": [
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}

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