8, 11-Octadecadienoic Acid

8, 11-Octadecadienoic Acid
Compound Structure:
Synonyms: 8,11-OCTADECADIENOIC ACID;(8E,11E)-octadeca-8,11-dienoic acid;C18:2n-7,10;2197-52-6;SCHEMBL891599;CHEBI:196559;LMFA01030336
Compound ID: NMPC-497
PubChem ID:

5312487
Molecular Formula: C18H32O2
Canonical SMILES: CCCCCCC=CCC=CCCCCCCC(=O)O
InChIKey: WBTBKRBXTLZUJG-ZDVGBALWSA-N
About the compound:
Properties:

Chemical and Physical Properties

Property Name

Property Value

Molecular Weight

280.4 g/mol

XLogP3

6.8

Hydrogen Bond Donor Count

1

Hydrogen Bond Acceptor Count

2

Rotatable Bond Count

14

Exact Mass

280.240230259 g/mol

Monoisotopic Mass

280.240230259 g/mol

Topological Polar Surface Area

37.3Ų

Heavy Atom Count

20

Formal Charge

0

Complexity

267

Isotope Atom Count

0

Defined Atom Stereocenter Count

0

Undefined Atom Stereocenter Count

0

Defined Bond Stereocenter Count

2

Undefined Bond Stereocenter Count

0

Covalently-Bonded Unit Count

1

Compound Is Canonicalized

Yes

Source: PubChem                                                         
Source Species: Curculigo pilosa
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