Consensus flow list

1,2,3,4,7,7-hexachlorobicyclo[2.2.1]hepta-2,5-diene

fo-d65b40a890e42faf

Identity

Type
NeutralMolecule
CAS
3389-71-7
EC
222-220-8
Origin
EF 3.1 hybrid_name_cas_v1
Changes
55 across every transformer

Structure

Structure diagram for 1,2,3,4,7,7-hexachlorobicyclo[2.2.1]hepta-2,5-diene

Alternative labels

4

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string IHAXIFZOERJWDF-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C7H2Cl6/c8-3-4(9)6(11)2-1-5(3,10)7(6,12)13/h1-2H
IUPAC name chemrof:IUPAC_name 1,2,3,4,7,7-hexachlorobicyclo[2.2.1]hepta-2,5-diene
Molecular formula chemrof:molecular_formula C7H2Cl6
Molecular mass chemrof:molecular_mass 298.811
Monoisotopic mass chemrof:monoisotopic_mass 295.828766
SMILES string chemrof:smiles_string ClC1=C(Cl)C2(Cl)C=CC1(Cl)C2(Cl)Cl

Known URLs

9

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=3389-71-7 enrich_references.consensus_cas_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.020.201 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID00875710 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=46471 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/ZD9UQS8QGB enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J127.145H enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/18820 enrich_references.pubchem_compound
PubChem https://pubchem.ncbi.nlm.nih.gov/erg/#2996 enrich_references.pubchem_identifier_url
wikidata.org https://www.wikidata.org/wiki/Q82857165 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
344b19b6-af9e-40e4-85bb-a1ff1eef6951 Environmental → Air → Aircraft cruise height EF 3.1 kg 2
45459f05-e860-43e5-891b-1b7cad7b7106 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
579ff30f-80fc-47d4-bafa-d27b5f781673 Environmental → Air → Indoor EF 3.1 kg 2
bc8021df-7bd1-4ca0-aa97-d517cdd2f065 Environmental → Air → Long-term EF 3.1 kg 0
6762b2a3-a982-45fc-a98f-eba21919caf1 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
b3c4d4b5-58fb-4519-9478-0d2f2337eb7f Environmental → Air → Unknown EF 3.1 kg 2
fc201f7a-03b9-436a-96ce-9e4eb0d02b0b Environmental → Ground → Agricultural EF 3.1 kg 2
c974f3c6-ba64-422d-9407-dc2d63b1fea9 Environmental → Ground → Non-agricultural EF 3.1 kg 2
75397271-557f-465b-a445-07c72b7f85bd Environmental → Ground → Unknown EF 3.1 kg 2
5cb34904-fdd1-451c-961b-396aa6d431dc Environmental → Water → Long-term EF 3.1 kg 0
426710e0-881a-4c5e-81b5-e6f806869ae4 Environmental → Water → Ocean EF 3.1 kg 2
5b0f21ea-c88a-4fa8-881e-47b9d049869d Environmental → Water → Surface water EF 3.1 kg 2
31f7de44-5bc2-4b29-9139-d73c4690a3ec Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (55 changes)

Open the changes page

Full record

Flow object JSON 
{
  "flow_object_id": "fo-d65b40a890e42faf",
  "prefLabel": [
    {
      "@value": "1,2,3,4,7,7-hexachlorobicyclo[2.2.1]hepta-2,5-diene",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "1,2,3,4,7,7-Hexachloro-2,5-norbornadiene",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "1,2,3,4,7,7-Hexachloronorbornadiene",
      "@language": "en",
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      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "2,5-Norbornadiene, 1,2,3,4,7,7-hexachloro-",
      "@language": "en",
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    },
    {
      "@value": "Bicyclo[2.2.1]hepta-2,5-diene, 1,2,3,4,7,7-hexachloro-",
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}

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