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Exo-methylcamphenilol
ScientificNameLabel
Exo-methylcamphenilol
PHCD compound ID :
855
Chemical Names :
Exo-methylcamphenilol
Molecular Formula :
C10H18O1
Molecular Weight :
154.135765
More Details :
Names & Synonyms:
(1S,2R,4R)-2,3,3-trimethylnorbornan-2-ol , (1R,3R,4S)-2,2,3-trimethyl-3-bicyclo[2.2.1]heptanol , (1R,3R,4S)-2,2,3-trimethylbicyclo[2.2.1]heptan-3-ol
Smiles:
CC1(C)[C@@H]2CC[C@H]([C@@]1(C)O)C2
InChi :
InChI=1S/C10H18O/c1-9(2)7-4-5-8(6-7)10(9,3)11/h7-8,11H,4-6H2,1-3H3/t7-,8+,10-/m1/s1
InChi Key :
InChIKey=PXRCIOIWVGAZEP-KHQFGBGNSA-N
PubChem ID :
12302327
Rotatable bond count :
0
Rule of five :
0
Hydrogen bond acceptor count :
1
Ionization potential :
9.938231
Hydrogen bond donor count :
1
Electric dipole moment :
1.735
XLogP :
2.334
VDW volume :
165.593614
Molecular weight :
154.135765
HOMO-LUMO gap :
13.009000
Herb list :
Thyme, Garden thyme - Thymus vulgaris - آويشن باغی
Refrences & Litretures:
71. Journal:'Food Chemistry' Year:'2005' Volume:'91' Page:'131' DOI:'10.1016/j.foodchem.2004.05.056' Title:'Identi?cation of volatile components in basil (Ocimum basilicum L.) and thyme leaves (Thymus vulgaris L.) and their antioxidant properties'
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