CAS 1191-75-9 | 7-Hexadecenoic acid | CAS Number 1191-75-9

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1191-75-9 | 7-Hexadecenoic acid

CAS No: 1191-75-9 Catalog No: AG000I7H MDL No:

Product Description

Catalog Number:

AG000I7H

Chemical Name:

7-Hexadecenoic acid

CAS Number:

1191-75-9

Molecular Formula:

C16H30O2

Molecular Weight:

254.4082

IUPAC Name:

hexadec-7-enoic acid

InChI:

InChI=1S/C16H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18/h9-10H,2-8,11-15H2,1H3,(H,17,18)

InChI Key:

PJHOFUXBXJNUAC-UHFFFAOYSA-N

SMILES:

CCCCCCCCC=CCCCCCC(=O)O

Properties

Complexity:

209

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

254.225g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

254.414g/mol

Monoisotopic Mass:

254.225g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

37.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

6.4

Literature

Title	Journal
Endogenous red blood cell membrane fatty acids and sudden cardiac arrest.	Metabolism: clinical and experimental 20100701
Linking egg thiamine and fatty acid concentrations of Lake Michigan lake trout with early life stage mortality.	Journal of aquatic animal health 20091201
Linking autotrophic activity in environmental samples with specific bacterial taxa by detection of 13C-labelled fatty acids.	Environmental microbiology 20031101