CAS 14167-66-9 | Heptacosane, 3-methyl- | CAS Number 14167-66-9

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14167-66-9 | Heptacosane, 3-methyl-

CAS No: 14167-66-9 Catalog No: AG001GUO MDL No:

Product Description

Catalog Number:

AG001GUO

Chemical Name:

Heptacosane, 3-methyl-

CAS Number:

14167-66-9

Molecular Formula:

C28H58

Molecular Weight:

394.7601

IUPAC Name:

3-methylheptacosane

InChI:

InChI=1S/C28H58/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28(3)5-2/h28H,4-27H2,1-3H3

InChI Key:

NTRHFQVDDLHZMZ-UHFFFAOYSA-N

SMILES:

CCCCCCCCCCCCCCCCCCCCCCCCC(CC)C

Properties

Complexity:

257

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

394.454g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

394.772g/mol

Monoisotopic Mass:

394.454g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

0A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

15.1

Literature

Title	Journal
Deciphering the signature of cuticular lipids with contact sex pheromone function in a parasitic wasp.	The Journal of experimental biology 20120715
Mechanisms of social regulation change across colony development in an ant.	BMC evolutionary biology 20100101
Abstracts from the XIII International Entomophagous Insects Workshop, July 27-31, 2003, Tucson, Arizona, USA.	Journal of insect science (Online) 20030101
Synthesis of the enantiomers of some methyl-branched cuticular hydrocarbons of the ant, Diacamma sp.	Bioscience, biotechnology, and biochemistry 20010201