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ScientificNameLabel
1-Docosanol
PHCD compound ID : 265
Chemical Names :
1-Docosanol
Molecular Formula : C22H46O1
Molecular Weight : 326.354866
More Details :
Names & Synonyms: docosan-1-ol , 1-docosanol
Smiles: CCCCCCCCCCCCCCCCCCCCCCO
InChi : InChI=1S/C22H46O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23/h23H,2-22H2,1H3
InChi Key : InChIKey=NOPFSRXAKWQILS-UHFFFAOYSA-N
PubChem ID : 12620
Rotatable bond count : 20 Rule of five : 2
Hydrogen bond acceptor count : 1 Ionization potential : 10.457046
Hydrogen bond donor count : 1 Electric dipole moment : 1.834
XLogP : 11.093 VDW volume : 397.858347
Molecular weight : 326.354866 HOMO-LUMO gap : 13.352000
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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