Chemical Properties of cis,cis-3-Methyl-4-cyclohexene-1,2-dicarboxylic acid anhydride (CAS 35438-82-5)

cis,cis-3-Methyl-4-cyclohexene-1,2-dicarboxylic acid anhydride

InChI
InChI=1S/C9H10O3/c1-5-3-2-4-6-7(5)9(11)12-8(6)10/h2-3,5-7H,4H2,1H3/t5-,6-,7+/m1/s1
InChI Key
XPEKVUUBSDFMDR-QYNIQEEDSA-N
Formula
C9H10O3
SMILES
CC1C=CCC2C(=O)OC(=O)C12
Molecular Weight1
166.17
CAS
35438-82-5
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Physical Properties

Property Value Unit Source
ΔfH°solid -199.20 ± 1.30 kJ/mol NIST
ΔfusH° 19.41 kJ/mol Joback Calculated Property
logPoct/wat 0.898 Crippen Calculated Property
McVol 120.660 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.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
ΔsubH 49.50 ± 1.00 kJ/mol 325.00 NIST

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [163.13; 427.50] 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-3.53400e+01
Coefficient B8.45420e-01
Coefficient C-4.53080e-04
Coefficient D7.05000e-08
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 163.13 J/mol×K 273.00 Calculated Property
Cp,gas 210.17 J/mol×K 353.78 Calculated Property
Cp,gas 252.27 J/mol×K 434.56 Calculated Property
Cp,gas 289.66 J/mol×K 515.33 Calculated Property
Cp,gas 322.56 J/mol×K 596.11 Calculated Property
Cp,gas 351.19 J/mol×K 676.89 Calculated Property
Cp,gas 375.78 J/mol×K 757.67 Calculated Property
Cp,gas 396.54 J/mol×K 838.44 Calculated Property
Cp,gas 413.71 J/mol×K 919.22 Calculated Property
Cp,gas 427.50 J/mol×K 1000.00 Calculated Property

Similar Compounds

3-Methyl-4-cyclohexene-1,2-dicarboxylic anhydride. cis-Bicyclo[2.2.2]oct-5-en-2,3-dicarboxylic acid, anhydride. 4,7-Ethanoisobenzofuran-1,3-dione, 3a,4,7,7a-tetrahydro-, (3a«alpha»,4«alpha»,7«alpha»,7a«alpha»)-. (1«alpha»,2«alpha»,3«beta»,6«beta»)-1,2,3,6-tetrahydro-3,6-methanophthalic anhydride. Carbic anhydride. 1,3-Isobenzofurandione, 3a,4,7,7a-tetrahydro-. cis-1,2,3,6-Tetrahydrophthalic anhydride. trans-carbomethoxy-2-methylcyclohex-3-ene. cis-1-carbomethoxy-2-methylcyclohex-3-ene. trans-carbomethoxy-2-tert-butylcyclohex-3-ene. cis-1-carbomethoxy-2-tert-butylcyclohex-3-ene. cis-3-Methyl-4-cyclohexene-1,2-dicarboxylic acid. 4-Methyl-4-cyclohexene-1,2-dicarboxylic anhydride. cis-Cyclohex-4-en-1,2-dicarboxylic acid, di(2-methylbutyl) ester. 4-Cyclohexene-1,2-dicarboxylic acid, di-(2-methylpropyl) ester.

Find more compounds similar to cis,cis-3-Methyl-4-cyclohexene-1,2-dicarboxylic acid anhydride.

Sources

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