1,2-Naphthalene decahydrodimethyl

ScientificNameLabel

1,2-Naphthalene decahydrodimethyl
PHCD compound ID :	1372
Chemical Names :	1,2-Naphthalene decahydrodimethyl
Molecular Formula :	C12H22
Molecular Weight :	166.172151

More Details :

Names & Synonyms:	1,2-dimethyldecalin , 1,2-dimethyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene
Smiles:	C[C@@H]1CC[C@@H]2[C@@H]([C@H]1C)CCCC2
InChi :	InChI=1S/C12H22/c1-9-7-8-11-5-3-4-6-12(11)10(9)2/h9-12H,3-8H2,1-2H3/t9-,10+,11-,12-/m1/s1
InChi Key :	InChIKey=FHEIPFHZECVFRS-WRWGMCAJSA-N
PubChem ID :	565551

Rotatable bond count :	0	Rule of five :	1
Hydrogen bond acceptor count :	0	Ionization potential :	10.206464
Hydrogen bond donor count :	0	Electric dipole moment :	0.118
XLogP :	6.244	VDW volume :	191.395357
Molecular weight :	166.172151	HOMO-LUMO gap :	13.961000

Herb list :

Rice - Oryza sativa - برنج

Refrences & Litretures:


145. Journal:'Journal of Essential Oil Bearing Plants' Year:'2012' Volume:'15' Page:'645' DOI:'10.1080/0972060X.2012.10644099' Title:'The Frist Research on The Essential Oil of Iranian Rice (Oryza sativa L.)'

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