Chemical Properties of Oxiranecarbonitrile, 3-methyl-3-phenyl-

Oxiranecarbonitrile, 3-methyl-3-phenyl-

InChI
InChI=1S/C10H9NO/c1-10(9(7-11)12-10)8-5-3-2-4-6-8/h2-6,9H,1H3
InChI Key
QCAMDQRKWIVWKA-UHFFFAOYSA-N
Formula
C10H9NO
SMILES
CC1(c2ccccc2)OC1C#N
Molecular Weight1
159.19
Other Names
  • 3-methyl-3-phenyl-oxiranecarbonitrile
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Physical Properties

Property Value Unit Source
ΔfusH° 18.09 kJ/mol Joback Calculated Property
logPoct/wat 1.824 Crippen Calculated Property
McVol 124.390 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.

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [154.00; 406.44] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A-1.00080e+02
Coefficient B1.22302e+00
Coefficient C-1.20390e-03
Coefficient D4.87400e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 154.00 J/mol×K 273.00 Calculated Property
Cp,gas 203.50 J/mol×K 353.78 Calculated Property
Cp,gas 244.04 J/mol×K 434.56 Calculated Property
Cp,gas 277.17 J/mol×K 515.33 Calculated Property
Cp,gas 304.42 J/mol×K 596.11 Calculated Property
Cp,gas 327.33 J/mol×K 676.89 Calculated Property
Cp,gas 347.44 J/mol×K 757.67 Calculated Property
Cp,gas 366.31 J/mol×K 838.44 Calculated Property
Cp,gas 385.46 J/mol×K 919.22 Calculated Property
Cp,gas 406.44 J/mol×K 1000.00 Calculated Property

Similar Compounds

ethyl methylphenyl glycidate 1. Oxiranecarboxylic acid, 3-methyl-3-phenyl-, ethyl ester. ethyl methylphenyl glycidate 2. 1,1,2,2-Cyclobutanetetracarbonitrile, 3-methoxy-3-phenyl-. 1,4-Dimethylindanyl acetate. Oxirane, 2-methyl-2-phenyl-. Cyclopropane-1-carboxylic acid, 2-methoxy-2-phenyl, ethyl ester, cis. Cyclopropane-1-carboxylic acid, 2-methoxy-2-phenyl, ethyl ester, trans. 4-Methyl-2-(2-methyltetrahydrofuran-2-yl)phenol. Calacorene oxide. 1-Phenylcyclohexane-cis-1,2-diol-diacetate. 1,4-Dioxane-2-carboxylic acid, 3-phenyl, ethyl ester. 1-Phenanthrenecarboxylic acid, 1,2,3,4,4a,10a-hexahydro-1,4a-dimethyl-7-(1-methylethyl)-, methyl ester, [1R-(1«alpha»,4a«beta»,10a«alpha»)]-. TMS 1-TMS-5-TMSOXY-3-(2-TMSAMINO)INDOLEPROPIONATE. 1,4-Dioxepane-2-carboxylic acid, 3-phenyl, ethyl ester, trans.

Find more compounds similar to Oxiranecarbonitrile, 3-methyl-3-phenyl-.

Sources

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