8-Octadecenoic acid,methyl ester

ScientificNameLabel

8-Octadecenoic acid,methyl ester
PHCD compound ID :	2481
Chemical Names :	8-Octadecenoic acid,methyl ester
Molecular Formula :	C19H36O2
Molecular Weight :	296.27153

More Details :

Names & Synonyms:	methyl (E)-octadec-8-enoate , (E)-8-octadecenoic acid methyl ester , (E)-octadec-8-enoic acid methyl ester
Smiles:	CCCCCCCCC/C=C/CCCCCCC(=O)OC
InChi :	InChI=1S/C19H36O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21-2/h11-12H,3-10,13-18H2,1-2H3/b12-11+
InChi Key :	InChIKey=KXOOHHMDCDXCBV-VAWYXSNFSA-N
PubChem ID :	5364422

Rotatable bond count :	16	Rule of five :	2
Hydrogen bond acceptor count :	2	Ionization potential :	9.607383
Hydrogen bond donor count :	0	Electric dipole moment :	1.495
XLogP :	8.513	VDW volume :	349.487703
Molecular weight :	296.27153	HOMO-LUMO gap :	10.753000

Herb list :

Henna - Lawsonia inermis - حنا

Refrences & Litretures:


286. Journal:'Int J Pharm Pharm Sci' Year:'2013' Volume:'5' Page:'617' DOI:'' Title:'GC-MS ANALYSIS OF LAWSONIA INERMIS SEED OIL'

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