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ScientificNameLabel
4-hepten-2-o1
PHCD compound ID : 2802
Chemical Names :
4-hepten-2-o1
Molecular Formula : C7H14O1
Molecular Weight : 114.104465
More Details :
Names & Synonyms: (Z)-hept-4-en-2-ol , (Z)-4-hepten-2-ol
Smiles: CC/C=C\C[C@H](O)C
InChi : InChI=1S/C7H14O/c1-3-4-5-6-7(2)8/h4-5,7-8H,3,6H2,1-2H3/b5-4-/t7-/m1/s1
InChi Key : InChIKey=KZUFTCBJDQXWOJ-IQXGSHKSSA-N
PubChem ID : 5352833
Rotatable bond count : 3 Rule of five : 0
Hydrogen bond acceptor count : 1 Ionization potential : 9.611368
Hydrogen bond donor count : 1 Electric dipole moment : 2.385
XLogP : 1.933 VDW volume : 135.782119
Molecular weight : 114.104465 HOMO-LUMO gap : 10.842000
Herb list :
Refrences & Litretures:
  
339.      Journal:'J. Agric. Food Chem'      Year:'1978'      Volume:'26'      Page:'1290'      DOI:'10.1021/jf60220a012'      Title:'Volatile components of corn silk (Zea mays L.): possible Heliothis zea (Boddie) attractants'
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