Brightway Flows 1.0
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4-(5,5,6-trimethylbicyclo[2.2.1]hept-2-yl)cyclohexanol

fo-83d0e4e459c58f61

Identity

Type
Neutral molecule
CAS
66068-84-6
EC
266-100-3
Origin
EF 3.1 hybrid_name_cas_v1
Changes
53 across every transformer

Structure

Structure diagram for 4-(5,5,6-trimethylbicyclo[2.2.1]hept-2-yl)cyclohexanol

Alternative labels

4

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string PCFHYANYPQEMPU-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C16H28O/c1-10-14-8-12(16(10,2)3)9-15(14)11-4-6-13(17)7-5-11/h10-15,17H,4-9H2,1-3H3
IUPAC name chemrof:IUPAC_name 4-(5,5,6-trimethylbicyclo[2.2.1]hept-2-yl)cyclohexanol
Molecular formula chemrof:molecular_formula C16H28O
Molecular mass chemrof:molecular_mass 236.399
Monoisotopic mass chemrof:monoisotopic_mass 236.214016
SMILES string chemrof:smiles_string CC1C2CC(CC2C2CCC(O)CC2)C1(C)C

Known URLs

8

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=66068-84-6 enrich_references.consensus_cas_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.060.072 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID4041816 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/TVJ25725XP enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J349.334B enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/106673 enrich_references.pubchem_compound
rxnav.nlm.nih.gov https://rxnav.nlm.nih.gov/id/rxnorm/2557378 enrich_references.pubchem_identifier_url
Wikidata https://www.wikidata.org/wiki/Q27290436 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
e1c03df5-34cd-41dd-afb9-21f172c70e0d Environmental → Air → Aircraft cruise height EF 3.1 kg 4
94975d7b-3af0-4bc6-8f11-f8212a4c3b8c Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
a5f390ee-fc45-4383-8bd6-14c156d57e67 Environmental → Air → Indoor EF 3.1 kg 4
d41205fb-1199-4d07-9bdf-95e42b1af248 Environmental → Air → Long-term EF 3.1 kg 0
98f5b6b7-eace-494e-b4be-02575352908e Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
e6cdea20-eed1-4bef-99dc-1b94e35d1f81 Environmental → Air → Unknown EF 3.1 kg 4
58bb6ee3-1b1e-4532-9a4e-985a661c77a0 Environmental → Ground → Agricultural EF 3.1 kg 4
3ace0872-51f5-467c-a634-2b25107f81d7 Environmental → Ground → Non-agricultural EF 3.1 kg 4
dae15c79-3f9a-4bb2-b2a0-06e3aac08776 Environmental → Ground → Unknown EF 3.1 kg 4
af8b146e-3385-4d1d-b400-45639a7a3f82 Environmental → Water → Long-term EF 3.1 kg 0
7ead40a0-94b3-458c-8113-9be87ee27e1f Environmental → Water → Ocean EF 3.1 kg 4
8e282de2-1224-4ecd-ae2f-3428d7c409c1 Environmental → Water → Surface water EF 3.1 kg 4
28d5c101-4769-47e1-980a-4f5b0d74dc25 Environmental → Water → Unknown EF 3.1 kg 4

History

Everything that changed this substance (53 changes)

Open the changes page

Full record

Flow object JSON 
{
  "flow_object_id": "fo-83d0e4e459c58f61",
  "prefLabel": [
    {
      "@value": "4-(5,5,6-trimethylbicyclo[2.2.1]hept-2-yl)cyclohexanol",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:hadPrimarySource": [
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        ],
        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "4-(5,5,6-Trimethylbicyclo[2.2.1]hept-2-yl)cyclohexan-1-ol",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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          "https://commonchemistry.cas.org/detail?cas_rn=66068-84-6"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "4-(5,5,6-Trimethylbicyclo[2.2.1]heptan-2-yl)cyclohexan-1-ol",
      "@language": "en",
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      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "4-Hydroxy-1-(5-isocamphyl)cyclohexane",
      "@language": "en",
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      "provenance": {
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      }
    },
    {
      "@value": "Cyclohexanol, 4-(5,5,6-trimethylbicyclo[2.2.1]hept-2-yl)-",
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}

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