9,12,15-Octadecatrien-1-ol

9,12,15-Octadecatrien-1-ol
Compound Structure:
Synonyms: 9,12,15-Octadecatrien-1-ol;(9E,12E,15E)-octadeca-9,12,15-trien-1-ol;9,12,15-Octadecatrienol;(9Z,12Z,15Z)-octadecatrien-1-ol;9,12,15-Octadecatrien-1-ol, (9Z,12Z,15Z)-;SCHEMBL290115;CHEBI:186635;LMFA05000216
Compound ID: NMPC-512
PubChem ID:

5367327
Molecular Formula: C18H32O
Canonical SMILES: CCC=CCC=CCC=CCCCCCCCCO
InChIKey: IKYKEVDKGZYRMQ-IUQGRGSQSA-N
About the compound:
Properties:

Chemical and Physical Properties

Property Name

Property Value

Molecular Weight

264.4 g/mol

XLogP3-AA

6.1

Hydrogen Bond Donor Count

1

Hydrogen Bond Acceptor Count

1

Rotatable Bond Count

13

Exact Mass

264.245315640 g/mol

Monoisotopic Mass

264.245315640 g/mol

Topological Polar Surface Area

20.2Ų

Heavy Atom Count

19

Formal Charge

0

Complexity

238

Isotope Atom Count

0

Defined Atom Stereocenter Count

0

Undefined Atom Stereocenter Count

0

Defined Bond Stereocenter Count

3

Undefined Bond Stereocenter Count

0

Covalently-Bonded Unit Count

1

Compound Is Canonicalized

Yes

Source: PubChem                                                         
Source Species: Gouania longipetala
Melanthera scadens
Synedrella nodiflora
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