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ScientificNameLabel
1-Hepten-4-ol
PHCD compound ID : 4639
Chemical Names :
1-Hepten-4-ol
Molecular Formula : C7H14O1
Molecular Weight : 114.104465
More Details :
Names & Synonyms: hept-1-en-4-ol , 1-hepten-4-ol
Smiles: CCC[C@@H](CC=C)O
InChi : InChI=1S/C7H14O/c1-3-5-7(8)6-4-2/h3,7-8H,1,4-6H2,2H3/t7-/m1/s1
InChi Key : InChIKey=AQTUHJABKZECGA-SSDOTTSWSA-N
PubChem ID : 19040
Rotatable bond count : 4 Rule of five : 0
Hydrogen bond acceptor count : 1 Ionization potential : 10.078494
Hydrogen bond donor count : 1 Electric dipole moment : 2.071
XLogP : 1.872 VDW volume : 135.782119
Molecular weight : 114.104465 HOMO-LUMO gap : 11.215000
Herb list :
Refrences & Litretures:
  
727.      Journal:'J Sci Food Agric'      Year:'2008'      Volume:'88'      Page:'280'      DOI:'10.1002/jsfa'      Title:'Antioxidant and antimicrobial activities of essential oil and various oleoresins of Elettaria cardamomum (seeds and pods)'
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