Chemical Properties of Cyclobutanone, 2,2,3-trimethyl-

Cyclobutanone, 2,2,3-trimethyl-

InChI
InChI=1S/C7H12O/c1-5-4-6(8)7(5,2)3/h5H,4H2,1-3H3
InChI Key
XCNUTNIUANPMKW-UHFFFAOYSA-N
Formula
C7H12O
SMILES
CC1CC(=O)C1(C)C
Molecular Weight1
112.17
Other Names
  • 2,2,3-Trimethylcyclobutanone
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Physical Properties

Property Value Unit Source
ΔfusH° 4.20 kJ/mol Joback Calculated Property
IE 9.20 eV Relay (1.0) Calculated Property
logPoct/wat 1.621 Crippen Calculated Property
McVol 100.200 ml/mol McGowan Calculated Property
Inp 787.00 NIST

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, 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 [130.35; 375.10] 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-6.64600e+01
Coefficient B9.07260e-01
Coefficient C-7.64000e-04
Coefficient D2.98300e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 130.35 J/mol×K 273.00 Calculated Property
Cp,gas 172.10 J/mol×K 353.78 Calculated Property
Cp,gas 208.00 J/mol×K 434.56 Calculated Property
Cp,gas 239.01 J/mol×K 515.33 Calculated Property
Cp,gas 266.07 J/mol×K 596.11 Calculated Property
Cp,gas 290.12 J/mol×K 676.89 Calculated Property
Cp,gas 312.10 J/mol×K 757.67 Calculated Property
Cp,gas 332.97 J/mol×K 838.44 Calculated Property
Cp,gas 353.65 J/mol×K 919.22 Calculated Property
Cp,gas 375.10 J/mol×K 1000.00 Calculated Property

Similar Compounds

Cyclohexanone, 2-isopropyl-2,5-dimethyl-. Hushinone. 2,2,4-Trimethylcyclopentanone. [1R-(1«alpha»,2«beta»,5«alpha»)]-2,6,6-trimethylbicyclo[3.1.1]heptan-3-one. [1S-(1«alpha»,2«beta»,5«alpha»)]-2,6,6-trimethylbicyclo[3.1.1]heptan-3-one. (E)-Pinanone. S-pinocamphone. Bicyclo[3.1.1]heptan-3-one, 2,6,6-trimethyl-, (1«alpha»,2«beta»,5«alpha»)-. Bicyclo[3.1.1]heptan-3-one, 2,6,6-trimethyl-. 1s,2r,5r-3-Pinanone. pinocamphone isomer (T). (Z)-Pinocamphone. 2(1H)-Naphthalenone, octahydro-1,1,4a-trimethyl-, trans-. Lanostan-3-one. 1(2H)-Naphthalenone, octahydro-4a,8a-dimethyl-7-(1-methylethyl)-, [4aR-(4a«alpha»,7«beta»,8a«alpha»)]-.

Find more compounds similar to Cyclobutanone, 2,2,3-trimethyl-.

Sources

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