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ScientificNameLabel
Decamethylene glycol
PHCD compound ID : 233
Chemical Names :
Decamethylene glycol
Molecular Formula : C10H22O2
Molecular Weight : 174.16198
More Details :
Names & Synonyms: decane-1,10-diol
Smiles: OCCCCCCCCCCO
InChi : InChI=1S/C10H22O2/c11-9-7-5-3-1-2-4-6-8-10-12/h11-12H,1-10H2
InChi Key : InChIKey=FOTKYAAJKYLFFN-UHFFFAOYSA-N
PubChem ID : 37153
Rotatable bond count : 9 Rule of five : 0
Hydrogen bond acceptor count : 2 Ionization potential : 10.573861
Hydrogen bond donor count : 2 Electric dipole moment : 2.525
XLogP : 2.5 VDW volume : 199.096758
Molecular weight : 174.16198 HOMO-LUMO gap : 13.377000
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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