Chemical Properties of 1,3-Cyclopentanedione, 2,2-dimethyl- (CAS 3883-58-7)

1,3-Cyclopentanedione, 2,2-dimethyl-

InChI
InChI=1S/C7H10O2/c1-7(2)5(8)3-4-6(7)9/h3-4H2,1-2H3
InChI Key
VXVZVJNSRQRUTI-UHFFFAOYSA-N
Formula
C7H10O2
SMILES
CC1(C)C(=O)CCC1=O
Molecular Weight1
126.15
CAS
3883-58-7
Other Names
  • 2,2-Dimethyl-1,3-cyclopentanedione
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Physical Properties

Property Value Unit Source
ΔfH°gas -332.49 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 0.54 kJ/mol Joback Calculated Property
IE [9.08; 9.22] eV Show Hide
IE 9.08 ± 0.05 eV NIST
IE 9.22 eV NIST
IE 9.22 eV NIST
logPoct/wat 0.945 Crippen Calculated Property
McVol 101.770 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, 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 [231.41; 306.74] J/mol×K [510.72; 753.88] Show Hide
Cp,gas 231.41 J/mol×K 510.72 Joback Calculated Property
Cp,gas 245.57 J/mol×K 551.25 Joback Calculated Property
Cp,gas 258.99 J/mol×K 591.77 Joback Calculated Property
Cp,gas 271.75 J/mol×K 632.30 Joback Calculated Property
Cp,gas 283.91 J/mol×K 672.83 Joback Calculated Property
Cp,gas 295.55 J/mol×K 713.36 Joback Calculated Property
Cp,gas 306.74 J/mol×K 753.88 Joback Calculated Property

Similar Compounds

Cyclopentanone, 2,2-dimethyl-. 2,2,4,4-tetramethylcyclopentane-1,3-dione. 1,3-Cyclohexanedione, 4,4-dimethyl-. Cyclohexanone, 2,2-dimethyl-. 2,2-Dimethyl-3-heptanone. 2,2-Dimethyl-3-octanone. 1,3-Cyclopentanedione, 2-methyl-. 2,2-Dimethylheptane-3,5-dione. [3.3.3]Propellane-2,8-dione. 3,3-Dimethyl-2,7-octanedione. 3-Hexanone, 2,2-dimethyl-. Cyclopentanone, 2-pentyl-3-(2-oxopropyl). 2,2,4-Trimethylcyclopentanone. Cyclopentanone, 2,2,5,5-tetramethyl-. 5,5-Dimethyl-2,4-heptanedione.

Find more compounds similar to 1,3-Cyclopentanedione, 2,2-dimethyl-.

Sources

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