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ScientificNameLabel
b-Pinene
PHCD compound ID : 2846
Chemical Names :
b-Pinene
Molecular Formula : C10H16
Molecular Weight : 136.125201
More Details :
Names & Synonyms: (1S,5S)-6,6-dimethyl-2-methylene-norpinane , (1S,5S)-6,6-dimethyl-4-methylenebicyclo[3.1.1]heptane , (1S,5S)-6,6-dimethyl-4-methylidenebicyclo[3.1.1]heptane , (1S,5S)-6,6-dimethyl-4-methylidene-bicyclo[3.1.1]heptane
Smiles: C=C1CC[C@H]2C[C@@H]1C2(C)C
InChi : InChI=1S/C10H16/c1-7-4-5-8-6-9(7)10(8,2)3/h8-9H,1,4-6H2,2-3H3/t8-,9-/m0/s1
InChi Key : InChIKey=WTARULDDTDQWMU-IUCAKERBSA-N
PubChem ID : 440967
Rotatable bond count : 0 Rule of five : 0
Hydrogen bond acceptor count : 0 Ionization potential : 9.513582
Hydrogen bond donor count : 0 Electric dipole moment : 0.898
XLogP : 4.222 VDW volume : 154.166929
Molecular weight : 136.125201 HOMO-LUMO gap : 10.766000
Herb list :
Refrences & Litretures:
  
353.      Journal:'Portugaliae Electrochimica Acta'      Year:'2011'      Volume:'29'      Page:'127'      DOI:'10.4152/pea.201102127'      Title:'Fennel (Foeniculum Vulgare) Essential Oil as Green Corrosion Inhibitor of Carbon Steel in Hydrochloric Acid Solution'
778.      Journal:'Industrial Crops and Products'      Year:'2013'      Volume:'49'      Page:'97'      DOI:'10.1016/j.indcrop.2013.04.029'      Title:'Influence of storage conditions on the essential oil composition ofThymus daenensis Celak'
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