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ScientificNameLabel
pentanol
PHCD compound ID : 633
Chemical Names :
1-pentanol , n-pentanol , Pentan-1-ol , pentanol , n-Amy1 alcohol
Molecular Formula : C5H12O1
Molecular Weight : 88.088815
More Details :
Names & Synonyms: pentan-1-ol , 1-pentanol
Smiles: CCCCCO
InChi : InChI=1S/C5H12O/c1-2-3-4-5-6/h6H,2-5H2,1H3
InChi Key : InChIKey=AMQJEAYHLZJPGS-UHFFFAOYSA-N
PubChem ID : 6276
Rotatable bond count : 3 Rule of five : 0
Hydrogen bond acceptor count : 1 Ionization potential : 10.568494
Hydrogen bond donor count : 1 Electric dipole moment : 2.097
XLogP : 1.42 VDW volume : 103.826609
Molecular weight : 88.088815 HOMO-LUMO gap : 13.451000
Herb list :
Refrences & Litretures:
  
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444.      Journal:'FLAVOUR AND FRAGRANCE JOURNAL'      Year:'1993'      Volume:'8'      Page:'209'      DOI:'10.1002/ffj.2730080408'      Title:'The Essential Oil of Rhus coriaria L. Fruits'
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552.      Journal:'Radiation Physics and Chemistry'      Year:'2009'      Volume:'78'      Page:'407'      DOI:'10.1016/j.radphyschem.2009.03.008'      Title:'Effect of ?-irradiation on the physicochemical and sensory properties of hazelnuts (Corylus avellana L.)'
589.      Journal:'Food Chemistry'      Year:'2004'      Volume:'84'      Page:'367'      DOI:'10.1016/S0308-8146(03)00241-3'      Title:'Changes in chemical composition of pumpkin seeds during the roasting process for production of pumpkin seed oil (Part 2: volatile compounds)'
773.      Journal:'CHEMISTRY & BIODIVERSITY'      Year:'2012'      Volume:'9'      Page:'359'      DOI:'10.1002/cbdv.201100326'      Title:'Determination of the Volatile Fraction of Polygonum bistorta L. at Different Growing Stages and Evaluation of Its Antimicrobial Activity against Two Major Honeybee (Apis mellifera) Pathogens'
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