Skip Navigation Links
ScientificNameLabel
Heptadacanoate
PHCD compound ID : 2078
Chemical Names :
n-Heptadecanoate , Heptadacanoate
Molecular Formula : C17H33O2
Molecular Weight : 269.248055
More Details :
Names & Synonyms: heptadecanoate
Smiles: CCCCCCCCCCCCCCCCC(=O)[O-]
InChi : InChI=1S/C17H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17(18)19/h2-16H2,1H3,(H,18,19)/p-1
InChi Key : InChIKey=KEMQGTRYUADPNZ-UHFFFAOYSA-M
PubChem ID : 4113470
Rotatable bond count : 15 Rule of five : 2
Hydrogen bond acceptor count : 2 Ionization potential : 4.316618
Hydrogen bond donor count : 0 Electric dipole moment : 44.527
XLogP : 7.658 VDW volume : 316.213963
Molecular weight : 269.248055 HOMO-LUMO gap : 9.123000
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'
Copyright © 2017, Chemistry and Chemical Engineering Research Center of Iran. All rights reserved.
Follow us