Chemical Properties of 1,3-Cyclohexanedione, 4,4-dimethyl-

1,3-Cyclohexanedione, 4,4-dimethyl-

InChI
InChI=1S/C8H12O2/c1-8(2)4-3-6(9)5-7(8)10/h3-5H2,1-2H3
InChI Key
PLGPBTCNKJQJHQ-UHFFFAOYSA-N
Formula
C8H12O2
SMILES
CC1(C)CCC(=O)CC1=O
Molecular Weight1
140.18
Cheméo is a service of Céondo GmbH, since 2007, we provide simulation, modelling and software development services for the industry. Do not hesitate to contact us for your projects.

Physical Properties

Property Value Unit Source
ΔcH°solid -4363.50 ± 1.30 kJ/mol NIST
ΔfH°gas -400.40 ± 2.70 kJ/mol NIST
ΔfH°solid -499.60 ± 1.70 kJ/mol NIST
ΔfusH° 1.03 kJ/mol Joback Calculated Property
ΔsubH° [99.20; 99.20] kJ/mol Show Hide
ΔsubH° 99.20 ± 2.10 kJ/mol NIST
ΔsubH° 99.20 ± 2.10 kJ/mol NIST
logPoct/wat 1.335 Crippen Calculated Property
McVol 115.860 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 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 [275.77; 362.57] J/mol×K [537.87; 785.42] Show Hide
Cp,gas 275.77 J/mol×K 537.87 Joback Calculated Property
Cp,gas 292.13 J/mol×K 579.13 Joback Calculated Property
Cp,gas 307.63 J/mol×K 620.39 Joback Calculated Property
Cp,gas 322.36 J/mol×K 661.64 Joback Calculated Property
Cp,gas 336.38 J/mol×K 702.90 Joback Calculated Property
Cp,gas 349.76 J/mol×K 744.16 Joback Calculated Property
Cp,gas 362.57 J/mol×K 785.42 Joback Calculated Property

Pressure Dependent Properties

Property Value Unit Pressure (kPa) Source
Tboilr 403.20 K 0.90 NIST

Similar Compounds

Cyclohexanone, 2,2-dimethyl-. 5,5-Dimethyl-2,4-heptanedione. 3,3-Dimethyl-2,7-octanedione. Cyclopentanone, 2,2-dimethyl-. 3,3-dimethylcyclohexanone. 1-Cyclohexanone, 2-methyl-2-(3-methyl-2-oxobutyl). Ethanone, 1-(1-methylcyclohexyl)-. 1-(1,2,2-Trimethylcyclopent-1-yl)-pentan-1,4-dione. 2,2,6,6,-Tetramethylcyclohexanone. Cyclopentanone, 2-pentyl-3-(2-oxopropyl). propyl-(1-adamantyl) ketone. Bicyclo[2.2.1]heptan-2-one, 1,4,7,7-tetramethyl-. 1,2-Cyclohexanedione, 3,3,6,6-tetramethyl-. Cyclohexanone, 2,2,6-trimethyl-. 1,3-Cyclohexanedione, 2,2,5,5-tetramethyl-.

Find more compounds similar to 1,3-Cyclohexanedione, 4,4-dimethyl-.

Sources

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
These property values are available through the Cheméo API. A free account gives you an access key.