3-Methyl-nonane

ScientificNameLabel

3-Methyl-nonane
PHCD compound ID :	3870
Chemical Names :	3-Methyl-nonane , Nonane,3-methyl-
Molecular Formula :	C10H22
Molecular Weight :	142.172151

More Details :

Names & Synonyms:	3-methylnonane
Smiles:	CCCCCC[C@@H](CC)C
InChi :	InChI=1S/C10H22/c1-4-6-7-8-9-10(3)5-2/h10H,4-9H2,1-3H3/t10-/m1/s1
InChi Key :	InChIKey=PLZDDPSCZHRBOY-SNVBAGLBSA-N
PubChem ID :	22202

Rotatable bond count :	6	Rule of five :	1
Hydrogen bond acceptor count :	0	Ionization potential :	10.797922
Hydrogen bond donor count :	0	Electric dipole moment :	0.067
XLogP :	5.969	VDW volume :	181.516305
Molecular weight :	142.172151	HOMO-LUMO gap :	14.676000

Herb list :

St John's wort - Hypericum perforatum - گل راعی، هوفاریقون ، گل شهناز

Refrences & Litretures:


522. Journal:'Maced. J. Chem. Chem. Eng' Year:'2015' Volume:'34' Page:'333' DOI:'' Title:'Essential oil composition of indigenous populations of Hypericum perforatum L. from southern Albania'
523. Journal:'Pharm Biol' Year:'2014' Volume:'52' Page:'175' DOI:'10.3109/13880209.2013.821663' Title:'Chemical composition and bioactivity of essential oils of Hypericum helianthemoides, Hypericum perforatum and Hypericum scabrum'

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