Chemical Properties of Cyclohexanone, 3,3,5,5-tetramethyl- (CAS 14376-79-5)

Cyclohexanone, 3,3,5,5-tetramethyl-

InChI
InChI=1S/C10H18O/c1-9(2)5-8(11)6-10(3,4)7-9/h5-7H2,1-4H3
InChI Key
OQJMHUOCLRCSED-UHFFFAOYSA-N
Formula
C10H18O
SMILES
CC1(C)CC(=O)CC(C)(C)C1
Molecular Weight1
154.25
CAS
14376-79-5
Other Names
  • 3,3,5,5-Tetramethylcyclohexanone
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Physical Properties

Property Value Unit Source
ΔfH°gas -333.01 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 1.48 kJ/mol Joback Calculated Property
IE 9.14 eV Relay (1.0) Calculated Property
logPoct/wat 2.792 Crippen Calculated Property
McVol 142.470 ml/mol McGowan Calculated Property
Tboil 475.25 K Relay (1.0) Calculated Property
Tfus 341.30 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, 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.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [338.78; 439.34] J/mol×K [511.38; 743.60] Show Hide
Cp,gas 338.78 J/mol×K 511.38 Joback Calculated Property
Cp,gas 358.04 J/mol×K 550.08 Joback Calculated Property
Cp,gas 376.04 J/mol×K 588.79 Joback Calculated Property
Cp,gas 392.97 J/mol×K 627.49 Joback Calculated Property
Cp,gas 409.03 J/mol×K 666.19 Joback Calculated Property
Cp,gas 424.42 J/mol×K 704.90 Joback Calculated Property
Cp,gas 439.34 J/mol×K 743.60 Joback Calculated Property

Correlations

Property Value Unit Temperature (K) Source
Pvap [1.33; 202.65] kPa [352.32; 526.81] The Yaws Handbook of Vapor Pressure Show Hide
Equationln(Pvp) = A + B/(T + C)
Coefficient A1.33507e+01
Coefficient B-3.64746e+03
Coefficient C-7.31030e+01
Temperature range, min.352.32
Temperature range, max.526.81
Pvap 1.33 kPa 352.32 Calculated Property
Pvap 3.11 kPa 371.71 Calculated Property
Pvap 6.56 kPa 391.10 Calculated Property
Pvap 12.67 kPa 410.48 Calculated Property
Pvap 22.81 kPa 429.87 Calculated Property
Pvap 38.63 kPa 449.26 Calculated Property
Pvap 62.14 kPa 468.65 Calculated Property
Pvap 95.61 kPa 488.03 Calculated Property
Pvap 141.55 kPa 507.42 Calculated Property
Pvap 202.65 kPa 526.81 Calculated Property

Similar Compounds

1,3-Cyclohexanedione, 5,5-dimethyl-. 2,7-Octanedione, 4,4,5,5-tetramethyl-. 3,3-dimethylcyclohexanone. Cyclohexane-1,3-dione, 2-acetyl-5,5-dimethyl-. Cyclohexanone, 3,3,5-trimethyl-. 1,3-Cyclohexanedione, 2,2,5,5-tetramethyl-. NEOPENTYL ETHYL KETONE. 1-t-Butyl-2-hexanone. 3,3,4,5-tetramethylcyclohexan-1-one. 6,6,10-Trimethyldecal-2-one. 1,4-Methanoazulen-7(1H)-one, octahydro-1,5,5,8a-tetramethyl-. SPIRO[4.5]DECAN-2-ONE. 2-Pentanone, 4,4-dimethyl-. 1,3-Cyclohexanedione, 2,5,5-trimethyl-. 2(1H)-Naphthalenone, octahydro-8a-methyl-, trans-.

Find more compounds similar to Cyclohexanone, 3,3,5,5-tetramethyl-.

Sources

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