CAS 15541-13-6 | 5,9-Octadecadienoic acid | CAS Number 15541-13-6

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15541-13-6 | 5,9-Octadecadienoic acid

CAS No: 15541-13-6 Catalog No: AG001NWT MDL No:

Product Description

Catalog Number:

AG001NWT

Chemical Name:

5,9-Octadecadienoic acid

CAS Number:

15541-13-6

Molecular Formula:

C18H32O2

Molecular Weight:

280.4455

IUPAC Name:

octadeca-5,9-dienoic acid

InChI:

InChI=1S/C18H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h9-10,13-14H,2-8,11-12,15-17H2,1H3,(H,19,20)

InChI Key:

DFJAXEWDHVOILU-UHFFFAOYSA-N

SMILES:

CCCCCCCCC=CCCC=CCCCC(=O)O

Properties

Complexity:

267

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

280.24g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

280.452g/mol

Monoisotopic Mass:

280.24g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

37.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

6.3

Literature

Title	Journal
First total synthesis of (5Z,9Z)-(+/-)-2-methoxy-5,9-octadecadienoic acid, a marine derived methoxylated analog of taxoleic acid.	Chemistry and physics of lipids 20081101
Total synthesis of 2-methoxy-14-methylpentadecanoic acid and the novel 2-methoxy-14-methylhexadecanoic acid identified in the sponge Agelas dispar.	Lipids 20021101
Abietoid seed fatty acid compositions--a review of the genera Abies, Cedrus, Hesperopeuce, Keteleeria, Pseudolarix, and Tsuga and preliminary inferences on the taxonomy of Pinaceae.	Lipids 20020101
A new delta 7-polyunsaturated fatty acid in Taxus spp. Seed lipids, dihomotaxoleic (7,11-20:2) acid.	Lipids 20010301