Chemical Properties of 2-Phenylbenzoxazole

2-Phenylbenzoxazole

InChI
InChI=1S/C13H9NO/c1-2-6-10(7-3-1)13-14-11-8-4-5-9-12(11)15-13/h1-9H
InChI Key
FIISKTXZUZBTRC-UHFFFAOYSA-N
Formula
C13H9NO
SMILES
c1ccc(-c2nc3ccccc3o2)cc1
Molecular Weight1
195.22
Other Names
  • 2-phenylbenzo[d]oxazole
  • Benzoxazole, 2-phenyl-
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Physical Properties

Property Value Unit Source
IE 8.48 eV Relay (1.0) Calculated Property
log10WS -4.22 Relay (1.0) Calculated Property
logPoct/wat 3.495 Crippen Calculated Property
McVol 147.200 ml/mol McGowan Calculated Property
Tboil 592.25 K Relay (1.0) Calculated Property
Tfus 376.15 K Jean-Claude Bradley Open Melting Point Dataset (2014, CC0) Compiled value

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
ΔvapH 90.90 kJ/mol 298.15 Thermochemical and conformational study of optical active phenylbenzazole derivatives

Similar Compounds

Phenol, 2-(2-benzoxazolyl)-. 2-Phenyl-4-benz[d]oxazinone. BENOXAPROFEN. 2-Phenyl-3,1-benzoxazin-4-one. 2,5-Bis(5-tert-butyl-2-benzoxazolyl)thiophene. Methyl salicylate, Rut, TFA. 4H,6h-m-dioxino[4',5':5,6]pyrano[4,3-d]-4-oxazolin-2-one, hexahydro-4-methoxy-1,8-diphenyl-. Methyl salicylate, Gly, TFA. Uridine, 2',5'-bis-O-TBDMS, 3'-O-TMS. 2',3'-Bis-(trimethylsiloxy)-5'-(tert-butyldimethylsiloxy)-uridine. Uridine, 2'-O-TBDMS, 3',5'-bis-O-TMS. O,O,O-Tris(tert-butyldimethylsilyl)uridine. Uridine, 2'-O-TMS, 3',5'-bis-TBDMS. Uridine, 2',3'-bis-O-TBDMS, 5'-O-TMS. 7,8-Dihydro-L-Biopterin, pentakis(trimethylsilyl) derivative.

Find more compounds similar to 2-Phenylbenzoxazole.

Sources

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