cis-2,6-Dimethyl-2,6-octadiene

ScientificNameLabel

cis-2,6-Dimethyl-2,6-octadiene
PHCD compound ID :	4317
Chemical Names :	cis-2,6-Dimethyl-2,6-octadiene
Molecular Formula :	C10H18
Molecular Weight :	138.140851

More Details :

Names & Synonyms:	(6Z)-2,6-dimethylocta-2,6-diene
Smiles:	C/C=C(\CCC=C(C)C)/C
InChi :	InChI=1S/C10H18/c1-5-10(4)8-6-7-9(2)3/h5,7H,6,8H2,1-4H3/b10-5-
InChi Key :	InChIKey=MZPDTOMKQCMETI-YHYXMXQVSA-N
PubChem ID :	5352478

Rotatable bond count :	3	Rule of five :	0
Hydrogen bond acceptor count :	0	Ionization potential :	9.044129
Hydrogen bond donor count :	0	Electric dipole moment :	0.634
XLogP :	4.194	VDW volume :	176.243388
Molecular weight :	138.140851	HOMO-LUMO gap :	10.292000

Herb list :

Damask rose, Persian rose - Rosa damascena - گل محمدی، گل گلاب

Refrences & Litretures:


633. Journal:'Journal of Biologically Active Products from Nature' Year:'2011' Volume:'1' Page:'19' DOI:'10.1080/22311866.2011.10719069' Title:'Chemical Composition and Antimicrobial Activity of Rosa damascena Mill Essential Oil'
634. Journal:'Chemistry of Natural Compounds' Year:'2009' Volume:'45' Page:'110' DOI:'' Title:'CHEMICAL COMPOSITION OF THE ESSENTIAL OILS OF Rosa damascena FROM TWO DIFFERENT LOCATIONS IN IRAN'

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