Skip Navigation Links
ScientificNameLabel
Trans-3-hexenal
PHCD compound ID : 4348
Chemical Names :
Trans-3-hexenal
Molecular Formula : C6H10O1
Molecular Weight : 98.073165
More Details :
Names & Synonyms: (E)-hex-3-enal , (E)-3-hexenal
Smiles: CC/C=C/CC=O
InChi : InChI=1S/C6H10O/c1-2-3-4-5-6-7/h3-4,6H,2,5H2,1H3/b4-3+
InChi Key : InChIKey=GXANMBISFKBPEX-ONEGZZNKSA-N
PubChem ID : 643139
Rotatable bond count : 3 Rule of five : 0
Hydrogen bond acceptor count : 1 Ionization potential : 9.723296
Hydrogen bond donor count : 0 Electric dipole moment : 2.868
XLogP : 1.967 VDW volume : 115.849676
Molecular weight : 98.073165 HOMO-LUMO gap : 10.377000
Herb list :
Refrences & Litretures:
  
638.      Journal:'Journal of Food Biochemistry'      Year:'2009'      Volume:'33'      Page:'331'      DOI:'10.1111/j.1745-4514.2009.00221.x'      Title:'BIOCHEMICAL CHARACTERIZATION OF BORAGE (BORAGO OFFICINALIS L.) SEEDS'
Copyright © 2017, Chemistry and Chemical Engineering Research Center of Iran. All rights reserved.
Follow us