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ScientificNameLabel
phenylpropyl alcohol
PHCD compound ID : 634
Chemical Names :
phenylpropyl alcohol
Molecular Formula : C9H12O1
Molecular Weight : 136.088815
More Details :
Names & Synonyms: 3-phenylpropan-1-ol , 3-phenyl-1-propanol
Smiles: OCCCc1ccccc1
InChi : InChI=1S/C9H12O/c10-8-4-7-9-5-2-1-3-6-9/h1-3,5-6,10H,4,7-8H2
InChi Key : InChIKey=VAJVDSVGBWFCLW-UHFFFAOYSA-N
PubChem ID : 31234
Rotatable bond count : 3 Rule of five : 0
Hydrogen bond acceptor count : 1 Ionization potential : 9.590378
Hydrogen bond donor count : 1 Electric dipole moment : 1.696
XLogP : 1.742 VDW volume : 141.844712
Molecular weight : 136.088815 HOMO-LUMO gap : 9.788000
Herb list :
Refrences & Litretures:
  
37.      Journal:'J. Agric. Food Chem'      Year:'2010'      Volume:'58'      Page:'3393'      DOI:'10.1021/jf9039759'      Title:'Chemical Assessment and in Vitro Antioxidant Capacity of Ficus carica Latex'
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