Chemical Properties of 5(4H)-Oxazolone, 2-phenyl-4-(phenylmethylene)-, (Z)- (CAS 17606-70-1)

5(4H)-Oxazolone, 2-phenyl-4-(phenylmethylene)-, (Z)-

InChI
InChI=1S/C16H11NO2/c18-16-14(11-12-7-3-1-4-8-12)17-15(19-16)13-9-5-2-6-10-13/h1-11H/b14-11+
InChI Key
VFDOKJVMHZUBTN-SDNWHVSQSA-N
Formula
C16H11NO2
SMILES
O=C1OC(c2ccccc2)=NC1=Cc1ccccc1
Molecular Weight1
249.26
CAS
17606-70-1
Other Names
  • 2-Oxazolin-5-one, 4-benzylidene-2-phenyl-
  • 4-Benzylidene-2-phenyl-5(4H)-oxazolone
  • 5(4H)-Oxazolone, 2-phenyl-4-(phenylmethylene)-
  • 4-Benzyliden-2-phenyl-4,5-dihydro-1,3-oxazol-5-on
  • 4-Benzylidene-2-phenyl-4,5-dihydro-1,3-oxazol-5-one
  • 4-Benzylidene-2-phenyl-1,3-oxazol-5(4H)-one
  • 2-Oxazolin-5-one, 4-benzylidene-2-phenyl-, (Z)-
  • (Z)-4-Benzylidene-2-phenyloxazolin-5-one
  • 4-Benzylidene-2-phenyl-1,3-oxazol-5(4H)-one, cis-
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Physical Properties

Property Value Unit Source
ΔcH°solid -7778.10 kJ/mol NIST
ΔfusH° 33.00 kJ/mol Joback Calculated Property
logPoct/wat 3.031 Crippen Calculated Property
McVol 186.740 ml/mol McGowan Calculated Property

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, 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, Ionization energy, Log10 of Water solubility in mol/l 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
Cp,gas [512.26; 577.95] J/mol×K [753.15; 1015.25] Show Hide
Cp,gas 512.26 J/mol×K 753.15 Joback Calculated Property
Cp,gas 526.45 J/mol×K 796.83 Joback Calculated Property
Cp,gas 539.20 J/mol×K 840.52 Joback Calculated Property
Cp,gas 550.61 J/mol×K 884.20 Joback Calculated Property
Cp,gas 560.80 J/mol×K 927.88 Joback Calculated Property
Cp,gas 569.88 J/mol×K 971.56 Joback Calculated Property
Cp,gas 577.95 J/mol×K 1015.25 Joback Calculated Property

Similar Compounds

5(4H)-Oxazolone, 2-phenyl-4-(phenylmethylene)-, (Z)-. Glycine-threonine-phenylalanine, N(«alpha»,«epsilon»)-trifluoroacetyl-N-O-permethyl derivative. Quinapril desethyl 3Me (Quinaprilate 3Me). 2'-Deoxyinosine, tris(tert-butyldimethylsilyl) derivative. 13-cis-Cinnamoyloxy-17-oxolupanine. N-Methyllaurotetanine. Azatadine M (nor, OH), acetylated. cis-Phenanthrene, 9,10-dihydro-9-methyl-9,10-diol, 3-methoxy, butylboronate. Azatadine M (OH), acetylated. L-Cysteine, S-(2-methoxy-2-oxoethyl)-N-[N-[N-[N-(1-oxopropyl)-L-phenylalanyl]-L-leucyl]glycyl]-, methyl ester. Inabenfide, N,O-bis(tert-butyldimethylsilyl)-. cis-Phenanthrene, 9,10-dihydro-9-methyl-9,10-diol, butylboronate. Inabenfide, N,O-bis(trimethylsilyl)-. naringin. Adenosine, 2'-deoxy-N-(trimethylsilyl)-3'-O-(trimethylsilyl)-, 5'-[bis(trimethylsilyl) phosphate].

Find more compounds similar to 5(4H)-Oxazolone, 2-phenyl-4-(phenylmethylene)-, (Z)-.

Sources

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