Consensus flow list

(Z)-dodec-7-enol

fo-21945c076767dd98

Identity

Type
NeutralMolecule
CAS
20056-92-2
EC
243-488-2
Origin
EF 3.1 hybrid_name_cas_v1
Changes
63 across every transformer

Structure

Structure diagram for (Z)-dodec-7-enol

This substance carries 2 candidate structures; the diagram is the first one RDKit could parse, not a settled answer.

Alternative labels

6

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string WWDOVTHLTQFGOZ-WAYWQWQTSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C12H24O/c1-2-3-4-5-6-7-8-9-10-11-12-13/h5-6,13H,2-4,7-12H2,1H3/b6-5-
Isomeric SMILES string chemrof:isomeric_smiles_string CCCC/C=C\CCCCCCO
IUPAC name chemrof:IUPAC_name (Z)-dodec-7-enol, (z)-dodec-7-enol
Molecular formula chemrof:molecular_formula C12H24O
Molecular mass chemrof:molecular_mass 184.323
Monoisotopic mass chemrof:monoisotopic_mass 184.182715
SMILES string chemrof:smiles_string CCCCC=CCCCCCCO

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=20056-92-2 enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.039.520 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID20274160 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J3.787G enrich_references.pubchem_identifier_url
lipidmaps.org https://lipidmaps.org/databases/lmsd/LMFA05000156 enrich_references.pubchem_identifier_url
metabolomicsworkbench.org https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=3246 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/5362794 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q67866080 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
69c12259-f1c0-446f-820a-9bff6869c635 Environmental → Air → Aircraft cruise height EF 3.1 kg 2
03a51c06-8caa-476c-968b-2dc8cd695561 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
7979355d-622a-4501-80aa-664a1137c529 Environmental → Air → Indoor EF 3.1 kg 2
0e439074-c4f5-46eb-b167-00461f54f20d Environmental → Air → Long-term EF 3.1 kg 0
7cdef925-62c6-4f95-b5ad-7fe9e609c354 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
62854615-4b08-47de-b499-b5c2219b8056 Environmental → Air → Unknown EF 3.1 kg 2
10797314-e971-4100-b155-7c814fdb4f47 Environmental → Ground → Agricultural EF 3.1 kg 2
2821923a-2a4a-4970-b069-27939f376a5d Environmental → Ground → Non-agricultural EF 3.1 kg 2
fff46b06-cdd7-4005-a1a4-7958d9bee88a Environmental → Ground → Unknown EF 3.1 kg 2
c5ec1f34-313f-470f-9ae2-83353771b105 Environmental → Water → Long-term EF 3.1 kg 0
320dfaf7-2648-423b-8661-ccf342e73910 Environmental → Water → Ocean EF 3.1 kg 2
d84b8b95-a869-4f1a-a043-fc8a9d94dc28 Environmental → Water → Surface water EF 3.1 kg 2
e8d1b78d-c8b7-4e1e-beb3-113d473f619e Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (63 changes)

Open the changes page

Full record

Flow object JSON 
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  "altLabel": [
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