Chemical Properties of exo-Bicyclo[2.2.1]heptan-2-carboxylic acid, 7,7-cyclopropano-, methyl ester

exo-Bicyclo[2.2.1]heptan-2-carboxylic acid, 7,7-cyclopropano-, methyl ester

InChI
InChI=1S/C11H16O2/c1-13-10(12)8-6-7-2-3-9(8)11(7)4-5-11/h7-9H,2-6H2,1H3/t7-,8-,9+/m1/s1
InChI Key
BOBIGPLBAPRCGC-HLTSFMKQSA-N
Formula
C11H16O2
SMILES
COC(=O)C1CC2CCC1C21CC1
Molecular Weight1
180.24
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Physical Properties

Property Value Unit Source
ΔfusH° 17.79 kJ/mol Joback Calculated Property
logPoct/wat 1.986 Crippen Calculated Property
McVol 140.710 ml/mol McGowan Calculated Property
Inp 1262.00 NIST
I 1639.00 NIST
Tboil 475.40 K Relay (1.0) Calculated Property

Cheméo can also estimate 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.

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [183.18; 548.14] 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-1.76480e+02
Coefficient B1.71212e+00
Coefficient C-1.61780e-03
Coefficient D6.30300e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 183.18 J/mol×K 273.00 Calculated Property
Cp,gas 254.66 J/mol×K 353.78 Calculated Property
Cp,gas 313.75 J/mol×K 434.56 Calculated Property
Cp,gas 362.46 J/mol×K 515.33 Calculated Property
Cp,gas 402.77 J/mol×K 596.11 Calculated Property
Cp,gas 436.67 J/mol×K 676.89 Calculated Property
Cp,gas 466.17 J/mol×K 757.67 Calculated Property
Cp,gas 493.25 J/mol×K 838.44 Calculated Property
Cp,gas 519.91 J/mol×K 919.22 Calculated Property
Cp,gas 548.14 J/mol×K 1000.00 Calculated Property

Similar Compounds

endo-Bicyclo[2.2.1]heptan-2-carboxylic acid, 7,7-cyclopropano, methyl ester. endo-Bicyclo[2.2.1]heptan-2-carboxylic acid, 7,7-dimethyl, methyl ester. exo-Bicyclo[2.2.1]heptan-2-carboxylic acid, 7,7-dimethyl, methyl ester. Cyclocopacamphan-12-yl methyl ether, B. Cyclocopacamphan-12-yl methyl ether, A. Methyl cyclocopacamphanoate. 22S-epi-17«beta»(H),21«beta»(H)-Hopanoic acid methyl ester. 22R-epi-17«beta»(H),21«beta»(H)-Hopanoic acid methyl ester. 22S-epi-28-Norhopanoic acid methyl ester. 22R-epi-28-Norhopanoic acid methyl ester. exo-Bicyclo[2.2.1]heptan-2-carboxylic acid, 7,7-cyclopropano-2-methyl, methyl ester. endo-Bicyclo[2.2.1]heptan-2-carboxylic acid, 7,7-cyclopropano-2-methyl, methyl ester. endo-Bicyclo[2.2.1]heptan-2-carboxylic acid, methyl ester. Bicyclo[2.2.1]heptane-2-carboxylic acid, methyl ester. [14C] GA25 16.alpha., 17-H2, 17-OH , methyl ester.

Find more compounds similar to exo-Bicyclo[2.2.1]heptan-2-carboxylic acid, 7,7-cyclopropano-, methyl ester.

Sources

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