cis-3- methyl-cyclopentene

ScientificNameLabel

cis-3- methyl-cyclopentene
PHCD compound ID :	2471
Chemical Names :	cis-3- methyl-cyclopentene
Molecular Formula :	C6H10
Molecular Weight :	82.07825

More Details :

Names & Synonyms:	3-methylcyclopentene
Smiles:	C[C@H]1CCC=C1
InChi :	InChI=1S/C6H10/c1-6-4-2-3-5-6/h2,4,6H,3,5H2,1H3/t6-/m1/s1
InChi Key :	InChIKey=CXOZQHPXKPDQGT-ZCFIWIBFSA-N
PubChem ID :	14263

Rotatable bond count :	0	Rule of five :	0
Hydrogen bond acceptor count :	0	Ionization potential :	9.531566
Hydrogen bond donor count :	0	Electric dipole moment :	0.461
XLogP :	2.833	VDW volume :	97.339449
Molecular weight :	82.07825	HOMO-LUMO gap :	10.775000

Herb list :

Betony - Stachys lavandulifolia Vahl - چای کوهی، سنبله ای زیبا

Refrences & Litretures:


285. Journal:'Journal of Herbal Drugs' Year:'2013' Volume:'4' Page:'137' DOI:'' Title:'Phytochemical of essential oil of Stachys lavandulifolia Vahl. collected from a natural habitat in western Isfahan, Iran'

Copyright © 2017, Chemistry and Chemical Engineering Research Center of Iran. All rights reserved.

Follow us