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ScientificNameLabel
Hexane
PHCD compound ID : 1454
Chemical Names :
Hexane , n-Hexane
Molecular Formula : C6H14
Molecular Weight : 86.10955
More Details :
Names & Synonyms: hexane , n-hexane
Smiles: CCCCCC
InChi : InChI=1S/C6H14/c1-3-5-6-4-2/h3-6H2,1-2H3
InChi Key : InChIKey=VLKZOEOYAKHREP-UHFFFAOYSA-N
PubChem ID : 8058
Rotatable bond count : 3 Rule of five : 0
Hydrogen bond acceptor count : 0 Ionization potential : 11.046923
Hydrogen bond donor count : 0 Electric dipole moment : 0.001
XLogP : 3.754 VDW volume : 112.332366
Molecular weight : 86.10955 HOMO-LUMO gap : 15.010000
Herb list :
Refrences & Litretures:
  
155.      Journal:'EJEAFChe'      Year:'2012'      Volume:'11'      Page:'493'      DOI:''      Title:'CHEMICAL COMPOSITION OF ESSENTIAL OIL OF ARTEMISIA VULGARIS FROM WEST AZERBAIJAN, IRAN'
288.      Journal:'Food Chemistry'      Year:'2011'      Volume:'125'      Page:'193'      DOI:'10.1016/j.foodchem.2010.08.060'      Title:'Antioxidant constituents from Lawsonia inermis leaves: Isolation, structure elucidation and antioxidative capacity'
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.)'
642.      Journal:'Journal of Essential Oil Bearing Plants'      Year:'2005'      Volume:'8'      Page:'61'      DOI:'10.1080/0972060X.2005.10643422'      Title:'Essential Oil Composition of Echium amoenum Fisch. & C.A. Mey'
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