Chemical Properties of 2-(t-Butylphenyl)-5-(4-biphenylyl)-1,3,4-oxadiazole (CAS 15082-28-7)

2-(t-Butylphenyl)-5-(4-biphenylyl)-1,3,4-oxadiazole

InChI
InChI=1S/C24H22N2O/c1-24(2,3)21-15-13-20(14-16-21)23-26-25-22(27-23)19-11-9-18(10-12-19)17-7-5-4-6-8-17/h4-16H,1-3H3
InChI Key
XZCJVWCMJYNSQO-UHFFFAOYSA-N
Formula
C24H22N2O
SMILES
CC(C)(C)c1ccc(-c2nnc(-c3ccc(-c4ccccc4)cc3)o2)cc1
Molecular Weight1
354.44
CAS
15082-28-7
Other Names
  • 2-(4-tert-Butylphenyl)-5-(4-biphenyl)-1,3,4-oxadiazole
  • 2-(4-tert-Butylphenyl)-5-(4-biphenylyl)-1,3,4,-oxadiazole
  • 1,3,4-Oxadiazole, 2-[1,1'-biphenyl]-4-yl-5-[4-(1,1-dimethylethyl)phenyl]-
  • Butyl-PBD
  • 1,3,4-Oxadiazole, 2-(4-biphenylyl)-5-(p-tert-butylphenyl)-
  • 2-(4-biphenylyl)-5-(4-tert-butylphenyl)-1,3,4-oxadiazole
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Physical Properties

Property Value Unit Source
ω 0.6863 Relay (1.0) Calculated Property
ΔfG° 470.98 kJ/mol Relay (1.0-beta) Calculated Property
ΔfH°gas 241.67 kJ/mol Relay (1.0) Calculated Property
ΔvapH° 142.20 kJ/mol Relay (1.0) Calculated Property
IE 8.40 eV Relay (1.0) Calculated Property
log10WS -7.94 Relay (1.0) Calculated Property
logPoct/wat 6.368 Crippen Calculated Property
McVol 284.110 ml/mol McGowan Calculated Property
Pc 1438.39 kPa Relay (1.0-beta) Calculated Property
Inp 3342.00 NIST
Tboil 736.33 K Relay (1.0) Calculated Property
Tc 1054.56 K Relay (1.0) Calculated Property
Tfus 399.68 K Relay (1.0) Calculated Property
Vc 1.074 m3/kmol Relay (1.0) Calculated Property

Similar Compounds

N-Desmethyltapentadol, N-trimethylsilyl-, trimethylsilyl ether. Phenanthro[1,2-b]furan-10,11-dione, 6,7,8,9-tetrahydro-1,6,6-trimethyl-. Methotrexate. Folic Acid. Levophacetoperane. Iprindole. Venlafaxine-M (O-desmethyl-HO-) isomer-1 2AC. Nabilone. Nabilone, trimethylsilyl ether. Penbutolol, TBDMS. N-Desmethyl-cis-tramadol, N-trimethylsilyl-, trimethylsilyl ether. Phenanthro[1,2-b]furan-10,11-dione, 6,7,8,9-tetrahydro-6-(hydroxymethyl)-1,6-dimethyl-, (-)-. Mebhydroline M (nor), acetylated. (-)-2-Aminobutan-1-ol, ferroceneboronate derivative. Dimetindene M (nor, OH), acetylated.

Find more compounds similar to 2-(t-Butylphenyl)-5-(4-biphenylyl)-1,3,4-oxadiazole.

Sources

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