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ScientificNameLabel
Methyl bornyl ether
PHCD compound ID : 4323
Chemical Names :
Methyl bornyl ether
Molecular Formula : C11H20O1
Molecular Weight : 168.151415
More Details :
Names & Synonyms: 2-methoxy-1,7,7-trimethyl-norbornane , 3-methoxy-4,7,7-trimethylbicyclo[2.2.1]heptane , 3-methoxy-4,7,7-trimethyl-bicyclo[2.2.1]heptane
Smiles: CO[C@@H]1C[C@H]2C([C@]1(C)CC2)(C)C
InChi : InChI=1S/C11H20O/c1-10(2)8-5-6-11(10,3)9(7-8)12-4/h8-9H,5-7H2,1-4H3/t8-,9+,11+/m0/s1
InChi Key : InChIKey=ZRHVOKYSOWTPIG-IQJOONFLSA-N
PubChem ID : 95330
Rotatable bond count : 1 Rule of five : 0
Hydrogen bond acceptor count : 1 Ionization potential : 9.620829
Hydrogen bond donor count : 0 Electric dipole moment : 1.270
XLogP : 3.253 VDW volume : 182.889599
Molecular weight : 168.151415 HOMO-LUMO gap : 12.222000
Herb list :
Refrences & Litretures:
  
634.      Journal:'Chemistry of Natural Compounds'      Year:'2009'      Volume:'45'      Page:'110'      DOI:''      Title:'CHEMICAL COMPOSITION OF THE ESSENTIAL OILS OF Rosa damascena FROM TWO DIFFERENT LOCATIONS IN IRAN'
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