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Naphthalene.2.7-bis(1.1-dimethylethyl)-
PHCD compound ID : 3783
Chemical Names :
Naphthalene.2.7-bis(1.1-dimethylethyl)-
Molecular Formula : C18H24
Molecular Weight : 240.187801
More Details :
Names & Synonyms: 2,7-ditert-butylnaphthalene
Smiles: CC(c1ccc2c(c1)cc(cc2)C(C)(C)C)(C)C
InChi : InChI=1S/C18H24/c1-17(2,3)15-9-7-13-8-10-16(18(4,5)6)12-14(13)11-15/h7-12H,1-6H3
InChi Key : InChIKey=IHRUNSCACKKOPP-UHFFFAOYSA-N
PubChem ID : 614367
Rotatable bond count : 2 Rule of five : 1
Hydrogen bond acceptor count : 0 Ionization potential : 8.660168
Hydrogen bond donor count : 0 Electric dipole moment : 0.461
XLogP : 6.768 VDW volume : 260.188971
Molecular weight : 240.187801 HOMO-LUMO gap : 8.376000
Herb list :
Refrences & Litretures:
  
513.      Journal:'J. of Supercritical Fluids'      Year:'2014'      Volume:'95'      Page:'373'      DOI:'10.1016/j.sup?u.2014.08.009'      Title:'Bio-oil production from Glycyrrhiza glabra through supercritical ?uid extraction'
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