Chemical Properties of 2-Methylbicyclo[2.2.1]-5-heptene-2-carboxylic acid (CAS 825-03-6)

2-Methylbicyclo[2.2.1]-5-heptene-2-carboxylic acid

InChI
InChI=1S/C9H12O2/c1-9(8(10)11)5-6-2-3-7(9)4-6/h2-3,6-7H,4-5H2,1H3,(H,10,11)
InChI Key
JIHFJSOMLKXSSQ-UHFFFAOYSA-N
Formula
C9H12O2
SMILES
CC1(C(=O)O)CC2C=CC1C2
Molecular Weight1
152.19
CAS
825-03-6
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Physical Properties

Property Value Unit Source
ΔfusH° 19.37 kJ/mol Joback Calculated Property
logPoct/wat 1.673 Crippen Calculated Property
McVol 119.090 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
Cp,gas [310.48; 380.35] J/mol×K [563.51; 791.85] Show Hide
Cp,gas 310.48 J/mol×K 563.51 Joback Calculated Property
Cp,gas 324.21 J/mol×K 601.57 Joback Calculated Property
Cp,gas 336.86 J/mol×K 639.62 Joback Calculated Property
Cp,gas 348.61 J/mol×K 677.68 Joback Calculated Property
Cp,gas 359.65 J/mol×K 715.74 Joback Calculated Property
Cp,gas 370.16 J/mol×K 753.79 Joback Calculated Property
Cp,gas 380.35 J/mol×K 791.85 Joback Calculated Property

Pressure Dependent Properties

Property Value Unit Pressure (kPa) Source
Tboilr 384.00 ± 1.00 K 0.33 NIST

Similar Compounds

exo-Bicyclo[2.2.1]hept-5-en-2-carboxylic acid, 2-methyl, methyl ester. endo-Bicyclo[2.2.1]hept-5-en-2-carboxylic acid, 2-methyl, methyl ester. Exo-bicyclo(2.2.1)hept-5-ene-2-carboxylic acid. Bicyclo[2.2.1]-5-heptene-2-carboxylic acid. exo-Bicyclo[2.2.1]hept-5-en-2-carboxylic acid, 7,7-cyclopropano-2-methyl, methyl ester. endo-Bicyclo[2.2.1]hept-5-en-2-carboxylic acid, 7,7-cyclopropano-2-methyl, methyl ester. Helifolen-12-oic acid (anti,anti,anti). Helifolen-12-oic acid (anti-syn-syn). Helifolen-12-oic acid (syn,anti,anti). Helifolen-12-oic acid (syn,syn,syn). (5S)-5-Methyl-5-hydroxymethylbicyclo[2.2.1]hept-2-ene. (5R)-5-Methyl-5-hydroxymethylbicyclo[2.2.1]hept-2-ene. Bicyclo[2.2.1]hept-5-ene-2-carboxylic acid, ethyl ester. Bicyclo[2.2.1]hept-5-ene-2-carboxylic acid, methyl ester, endo-. 5-Norbornene-2-carboxylic acid,methyl ester.

Find more compounds similar to 2-Methylbicyclo[2.2.1]-5-heptene-2-carboxylic acid.

Sources

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