Skip Navigation Links
ScientificNameLabel
3,3-Diethylheptadecane
PHCD compound ID : 3965
Chemical Names :
3,3-Diethylheptadecane
Molecular Formula : C21H44
Molecular Weight : 296.344301
More Details :
Names & Synonyms: 3,3-diethylheptadecane
Smiles: CCCCCCCCCCCCCCC(CC)(CC)CC
InChi : InChI=1S/C21H44/c1-5-9-10-11-12-13-14-15-16-17-18-19-20-21(6-2,7-3)8-4/h5-20H2,1-4H3
InChi Key : InChIKey=ZEFHGRZKMZQAKZ-UHFFFAOYSA-N
PubChem ID : 85977259
Rotatable bond count : 16 Rule of five : 2
Hydrogen bond acceptor count : 0 Ionization potential : 10.531885
Hydrogen bond donor count : 0 Electric dipole moment : 0.116
XLogP : 12.265 VDW volume : 371.772136
Molecular weight : 296.344301 HOMO-LUMO gap : 14.433000
Herb list :
Refrences & Litretures:
  
542.      Journal:'Folia Pomer. Univ. Technol. Stetin., Agric., Aliment., Pisc., Zootech'      Year:'2015'      Volume:'320'      Page:'95'      DOI:''      Title:'GC-MS ANALYSIS OF ESSENTIAL OILS ISOLATED FROM FRUITS OF CHOSEN HOT PEPPER (CAPSICUM ANNUUM L.) CULTIVARS'
Copyright © 2017, Chemistry and Chemical Engineering Research Center of Iran. All rights reserved.
Follow us