1,13-Tetradecadiene

ScientificNameLabel

1,13-Tetradecadiene
PHCD compound ID :	4327
Chemical Names :	1,13-Tetradecadiene
Molecular Formula :	C14H26
Molecular Weight :	194.203451

More Details :

Names & Synonyms:	tetradeca-1,13-diene
Smiles:	C=CCCCCCCCCCCC=C
InChi :	InChI=1S/C14H26/c1-3-5-7-9-11-13-14-12-10-8-6-4-2/h3-4H,1-2,5-14H2
InChi Key :	InChIKey=XMRSTLBCBDIKFI-UHFFFAOYSA-N
PubChem ID :	30875

Rotatable bond count :	11	Rule of five :	2
Hydrogen bond acceptor count :	0	Ionization potential :	10.095984
Hydrogen bond donor count :	0	Electric dipole moment :	0.031
XLogP :	7.574	VDW volume :	245.427326
Molecular weight :	194.203451	HOMO-LUMO gap :	11.226000

Herb list :

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

Refrences & Litretures:


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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