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ScientificNameLabel
3-Allyl-6-methoxyphenol
PHCD compound ID : 1783
Chemical Names :
3-Allyl-6-methoxyphenol
Molecular Formula : C10H12O2
Molecular Weight : 164.08373
More Details :
Names & Synonyms: 5-allyl-2-methoxy-phenol , 2-methoxy-5-prop-2-enylphenol , 2-methoxy-5-prop-2-enyl-phenol
Smiles: C=CCc1ccc(c(c1)O)OC
InChi : InChI=1S/C10H12O2/c1-3-4-8-5-6-10(12-2)9(11)7-8/h3,5-7,11H,1,4H2,2H3
InChi Key : InChIKey=NPBVQXIMTZKSBA-UHFFFAOYSA-N
PubChem ID : 596375
Rotatable bond count : 3 Rule of five : 0
Hydrogen bond acceptor count : 2 Ionization potential : 8.695532
Hydrogen bond donor count : 1 Electric dipole moment : 2.412
XLogP : 2.223 VDW volume : 165.294465
Molecular weight : 164.08373 HOMO-LUMO gap : 8.802000
Herb list :
Refrences & Litretures:
  
202.      Journal:'Biotech Health Sci'      Year:'2015'      Volume:'2'      Page:'e26797'      DOI:'10.17795/bhs-26797'      Title:'Biological Properties of Vitex agnus-castus Essential Oil (Phytochemical Component, Antioxidant and Antifungal Activity)'
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