5-Tridecene

ScientificNameLabel

5-Tridecene
PHCD compound ID :	1673
Chemical Names :	5-Tridecene
Molecular Formula :	C13H26
Molecular Weight :	182.203451

More Details :

Names & Synonyms:	(E)-tridec-5-ene , (E)-5-tridecene
Smiles:	CCCCCCC/C=C/CCCC
InChi :	InChI=1S/C13H26/c1-3-5-7-9-11-13-12-10-8-6-4-2/h9,11H,3-8,10,12-13H2,1-2H3/b11-9+
InChi Key :	InChIKey=VDFGUEPMNNLWOZ-PKNBQFBNSA-N
PubChem ID :	5364421

Rotatable bond count :	9	Rule of five :	1
Hydrogen bond acceptor count :	0	Ionization potential :	9.582819
Hydrogen bond donor count :	0	Electric dipole moment :	0.123
XLogP :	7.221	VDW volume :	230.7678
Molecular weight :	182.203451	HOMO-LUMO gap :	10.817000

Herb list :

Colt's foot, Horse hoof - Tussilago farfara - پای خر

Refrences & Litretures:


189. Journal:'Biochemical Systematics and Ecology' Year:'2012' Volume:'41' Page:'6' DOI:'10.1016/j.bse.2011.11.003' Title:'Metabolic ?ngerprinting investigation of Tussilago farfara L. by GC–MS and multivariate data analysis'

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