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ScientificNameLabel
16-Heptadecenal
PHCD compound ID : 251
Chemical Names :
16-Heptadecenal
Molecular Formula : C17H32O1
Molecular Weight : 252.245316
More Details :
Names & Synonyms: heptadec-16-enal , 16-heptadecenal
Smiles: C=CCCCCCCCCCCCCCCC=O
InChi : InChI=1S/C17H32O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18/h2,17H,1,3-16H2
InChi Key : InChIKey=JDOJVMJYUULLEN-UHFFFAOYSA-N
PubChem ID : 557527
Rotatable bond count : 15 Rule of five : 2
Hydrogen bond acceptor count : 1 Ionization potential : 10.101067
Hydrogen bond donor count : 0 Electric dipole moment : 2.738
XLogP : 8.187 VDW volume : 306.105507
Molecular weight : 252.245316 HOMO-LUMO gap : 10.811000
Herb list :
Refrences & Litretures:
  
14.      Journal:'Phytochem. Anal. 2014, 25, 273'      Year:'2014'      Volume:'25'      Page:'273'      DOI:'10.1002/pca.2503'      Title:'Chemometric Resolution Approaches in Characterisation of Volatile Constituents in Plantago ovata Seeds using Gas Chromatography–Mass Spectrometry: Methodology and Performance Assessment'
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