Skip Navigation Links
ScientificNameLabel
1-Monolinoleoylglycerol trimethylsilyl ether
PHCD compound ID : 1235
Chemical Names :
1-Monolinoleoylglycerol trimethylsilyl ether
Molecular Formula : C27H54O4Si2
Molecular Weight : 498.356063
More Details :
Names & Synonyms: 2,3-bis(trimethylsilyloxy)propyl (9Z,12Z)-octadeca-9,12-dienoate , (9Z,12Z)-octadeca-9,12-dienoic acid 2,3-bis(trimethylsilyloxy)propyl ester
Smiles: CCCCC/C=C\C/C=C/CCCCCCCC(=O)OC[C@@H](O[Si](C)(C)C)CO[Si](C)(C)C
InChi : InChI=1S/C27H54O4Si2/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-27(28)29-24-26(31-33(5,6)7)25-30-32(2,3)4/h12-13,15-16,26H,8-11,14,17-25H2,1-7H3/b13-12-,16-15+/t26-/m1/s1
InChi Key : InChIKey=ZSJCVZNRVUZSFU-SXIJOECMSA-N
PubChem ID : 5366692
Rotatable bond count : 22 Rule of five : 2
Hydrogen bond acceptor count : 4 Ionization potential : 9.574643
Hydrogen bond donor count : 0 Electric dipole moment : 1.191
XLogP : 11.075 VDW volume : 573.817263
Molecular weight : 498.356063 HOMO-LUMO gap : 10.642000
Herb list :
Refrences & Litretures:
  
130.      Journal:'J. Sci. Res'      Year:'2009'      Volume:'1'      Page:'387'      DOI:'10.3329/jsr.v1i2.1760'      Title:'Constituents of Peel and Leaf Essential Oils of Citrus Medica L'
Copyright © 2017, Chemistry and Chemical Engineering Research Center of Iran. All rights reserved.
Follow us