Skip Navigation Links
ScientificNameLabel
Coniferyl alcohol Coniferol
PHCD compound ID : 5509
Chemical Names :
Coniferyl alcohol Coniferol
Molecular Formula : C10H12O3
Molecular Weight : 180.078644
More Details :
Names & Synonyms: 4-[(E)-3-hydroxyprop-1-enyl]-2-methoxy-phenol , 4-[(E)-3-hydroxyprop-1-enyl]-2-methoxyphenol , 4-[(E)-3-hydroxyprop-1-enyl]-2-methoxyphenol , 2-methoxy-4-[(E)-3-oxidanylprop-1-enyl]phenol
Smiles: OC/C=C/c1ccc(c(c1)OC)O
InChi : InChI=1S/C10H12O3/c1-13-10-7-8(3-2-6-11)4-5-9(10)12/h2-5,7,11-12H,6H2,1H3/b3-2+
InChi Key : InChIKey=JMFRWRFFLBVWSI-NSCUHMNNSA-N
PubChem ID : 1549095
Rotatable bond count : 3 Rule of five : 0
Hydrogen bond acceptor count : 3 Ionization potential : 8.613156
Hydrogen bond donor count : 2 Electric dipole moment : 3.055
XLogP : 0.684 VDW volume : 174.084692
Molecular weight : 180.078644 HOMO-LUMO gap : 8.414000
Herb list :
Refrences & Litretures:
  
923.      Journal:'Letters in Applied NanoBioScience'      Year:'2020'      Volume:'9'      Page:'849'      DOI:'10.33263/LIANBS91.849852'      Title:'Chemical composition and antibacterial activity of methanolic extract from Echinops robustus on typical food-borne pathogens'
Copyright © 2017, Chemistry and Chemical Engineering Research Center of Iran. All rights reserved.
Follow us