3-Methylnonacosane-1-ol

ScientificNameLabel

3-Methylnonacosane-1-ol
PHCD compound ID :	2511
Chemical Names :	3-Methylnonacosane-1-ol
Molecular Formula :	C30H62O1
Molecular Weight :	438.480067

More Details :

Names & Synonyms:	3-methylnonacosan-1-ol , 3-methyl-1-nonacosanol
Smiles:	CCCCCCCCCCCCCCCCCCCCCCCCCC[C@H](CCO)C
InChi :	InChI=1S/C30H62O/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-30(2)28-29-31/h30-31H,3-29H2,1-2H3/t30-/m1/s1
InChi Key :	InChIKey=KRYFHCLJLPIRLE-SSEXGKCCSA-N
PubChem ID :	11026530

Rotatable bond count :	27	Rule of five :	2
Hydrogen bond acceptor count :	1	Ionization potential :	10.436597
Hydrogen bond donor count :	1	Electric dipole moment :	1.970
XLogP :	15.584	VDW volume :	536.226224
Molecular weight :	438.480067	HOMO-LUMO gap :	13.342000

Herb list :

Henna - Lawsonia inermis - حنا

Refrences & Litretures:


289. Journal:'International Journal of Pharmaceutical Sciences and Drug Research' Year:'2010' Volume:'2' Page:'91' DOI:'' Title:'Lawsonia inermis Linnaeus: A Phytopharmacological Review'

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