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(Z)-1-Methyl-4-(1-methylethyl)cyclohex-2-en-1-ol
ScientificNameLabel
(Z)-1-Methyl-4-(1-methylethyl)cyclohex-2-en-1-ol
PHCD compound ID :
2430
Chemical Names :
(Z)-1-Methyl-4-(1-methylethyl)cyclohex-2-en-1-ol
Molecular Formula :
C10H18O1
Molecular Weight :
154.135765
More Details :
Names & Synonyms:
(1R,4R)-4-isopropyl-1-methyl-cyclohex-2-en-1-ol , (1R,4R)-1-methyl-4-propan-2-yl-1-cyclohex-2-enol , (1R,4R)-1-methyl-4-propan-2-ylcyclohex-2-en-1-ol , (1R,4R)-1-methyl-4-propan-2-yl-cyclohex-2-en-1-ol
Smiles:
CC([C@H]1CC[C@@](C=C1)(C)O)C
InChi :
InChI=1S/C10H18O/c1-8(2)9-4-6-10(3,11)7-5-9/h4,6,8-9,11H,5,7H2,1-3H3/t9-,10+/m1/s1
InChi Key :
InChIKey=IZXYHAXVIZHGJV-ZJUUUORDSA-N
PubChem ID :
122485
Rotatable bond count :
1
Rule of five :
0
Hydrogen bond acceptor count :
1
Ionization potential :
9.927921
Hydrogen bond donor count :
1
Electric dipole moment :
2.392
XLogP :
2.77
VDW volume :
175.313614
Molecular weight :
154.135765
HOMO-LUMO gap :
10.817000
Herb list :
Nutmeg - Myristica fragrans - جوز بویا
Refrences & Litretures:
272. Journal:'CHEMISTRY & BIODIVERSITY' Year:'2014' Volume:'11' Page:'1449' DOI:'' Title:'Chemical Constituents and Activities of the Essential Oil from Myristica fragrans against Cigarette Beetle Lasioderma serricorne'
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