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ScientificNameLabel
2-Hexyl-1-octanol
PHCD compound ID : 243
Chemical Names :
2-Hexyl-1-octanol
Molecular Formula : C14H30O1
Molecular Weight : 214.229666
More Details :
Names & Synonyms: 2-hexyloctan-1-ol , 2-hexyl-1-octanol
Smiles: CCCCCCC(CCCCCC)CO
InChi : InChI=1S/C14H30O/c1-3-5-7-9-11-14(13-15)12-10-8-6-4-2/h14-15H,3-13H2,1-2H3
InChi Key : InChIKey=QNMCWJOEQBZQHB-UHFFFAOYSA-N
PubChem ID : 545551
Rotatable bond count : 11 Rule of five : 2
Hydrogen bond acceptor count : 1 Ionization potential : 10.329244
Hydrogen bond donor count : 1 Electric dipole moment : 1.605
XLogP : 6.269 VDW volume : 259.49047
Molecular weight : 214.229666 HOMO-LUMO gap : 13.336000
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'
909.      Journal:'Adv Pharm Bull'      Year:'2016'      Volume:'6'      Page:'163'      DOI:'10.15171/apb.2016.023'      Title:'Essential Oil from Flowers and Leaves of Elaeagnus Angustifolia (Elaeagnaceae): Composition, Radical Scavenging and General Toxicity Activities'
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