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ScientificNameLabel
2-Hexyl-1-decanol
PHCD compound ID : 249
Chemical Names :
2-Hexyl-1-decanol
Molecular Formula : C16H34O1
Molecular Weight : 242.260966
More Details :
Names & Synonyms: 2-hexyldecan-1-ol , 2-hexyl-1-decanol
Smiles: CCCCCCCC[C@@H](CCCCCC)CO
InChi : InChI=1S/C16H34O/c1-3-5-7-9-10-12-14-16(15-17)13-11-8-6-4-2/h16-17H,3-15H2,1-2H3/t16-/m1/s1
InChi Key : InChIKey=XULHFMYCBKQGEE-MRXNPFEDSA-N
PubChem ID : 95337
Rotatable bond count : 13 Rule of five : 2
Hydrogen bond acceptor count : 1 Ionization potential : 10.393960
Hydrogen bond donor count : 1 Electric dipole moment : 1.702
XLogP : 7.407 VDW volume : 294.082439
Molecular weight : 242.260966 HOMO-LUMO gap : 13.331000
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'
635.      Journal:'Analytica Chimica Acta'      Year:'2006'      Volume:'566'      Page:'172'      DOI:'10.1016/j.aca.2006.03.014'      Title:'Comparison of direct thermal desorption with water distillation and superheated water extraction for the analysis of volatile components of Rosa damascena Mill. using GCxGC-TOF/MS'
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