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ScientificNameLabel
n-Hexadecanoate
PHCD compound ID : 2077
Chemical Names :
n-Hexadecanoate
Molecular Formula : C16H31O2
Molecular Weight : 255.232405
More Details :
Names & Synonyms: hexadecanoate , palmitate
Smiles: CCCCCCCCCCCCCCCC(=O)[O-]
InChi : InChI=1S/C16H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18/h2-15H2,1H3,(H,17,18)/p-1
InChi Key : InChIKey=IPCSVZSSVZVIGE-UHFFFAOYSA-M
PubChem ID : 504166
Rotatable bond count : 14 Rule of five : 2
Hydrogen bond acceptor count : 2 Ionization potential : 4.276077
Hydrogen bond donor count : 0 Electric dipole moment : 35.517
XLogP : 7.089 VDW volume : 298.917978
Molecular weight : 255.232405 HOMO-LUMO gap : 9.256000
Herb list :
Refrences & Litretures:
  
249.      Journal:'Pak. J. Bot'      Year:'2008'      Volume:'40'      Page:'2553'      DOI:''      Title:'CHEMICAL CONSTITUENTS OF TAMARINDUS INDICA L. MEDICINAL PLANT IN SINDH'
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