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ScientificNameLabel
O-methoxycinnamaldehyde
PHCD compound ID : 2773
Chemical Names :
O-methoxycinnamaldehyde
Molecular Formula : C10H10O2
Molecular Weight : 162.06808
More Details :
Names & Synonyms: 3-(2-methoxyphenyl)prop-2-enal , 3-(2-methoxyphenyl)-2-propenal , 3-(2-methoxyphenyl)acrolein
Smiles: O=C/C=C/c1ccccc1OC
InChi : InChI=1S/C10H10O2/c1-12-10-7-3-2-5-9(10)6-4-8-11/h2-8H,1H3/b6-4+
InChi Key : InChIKey=KKVZAVRSVHUSPL-GQCTYLIASA-N
PubChem ID : 15173
Rotatable bond count : 3 Rule of five : 0
Hydrogen bond acceptor count : 2 Ionization potential : 9.146378
Hydrogen bond donor count : 0 Electric dipole moment : 5.611
XLogP : 1.153 VDW volume : 162.658006
Molecular weight : 162.06808 HOMO-LUMO gap : 8.350000
Herb list :
Refrences & Litretures:
  
322.      Journal:'Journal of Essential Oil Research'      Year:'2000'      Volume:'12'      Page:'537'      DOI:'10.1080/10412905.2000.9712153'      Title:'Chemical Composition of Leaf Oils of Cinnamomum from Madagascar: C. zeylanicum Blume, C. camphora L., C. fragrans Baillon and C. angustifolium'
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