Chemical Properties of Cyclopropanecarboxylic acid, 1,2-diphenyl-, methyl ester, trans-

Cyclopropanecarboxylic acid, 1,2-diphenyl-, methyl ester, trans-

InChI
InChI=1S/C17H16O2/c1-19-16(18)17(14-10-6-3-7-11-14)12-15(17)13-8-4-2-5-9-13/h2-11,15H,12H2,1H3/t15-,17-/m1/s1
InChI Key
YAOZVDIKXMRFBG-RDJZCZTQSA-N
Formula
C17H16O2
SMILES
COC(=O)[C@@]1(c2ccccc2)C[C@@H]1c1ccccc1
Molecular Weight1
252.31
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Physical Properties

Property Value Unit Source
ΔfusH° 25.15 kJ/mol Joback Calculated Property
IE 8.08 eV Relay (1.0) Calculated Property
logPoct/wat 3.285 Crippen Calculated Property
McVol 199.450 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, 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 [242.83; 661.16] 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-1.49260e+02
Coefficient B1.82252e+00
Coefficient C-1.56620e-03
Coefficient D5.54100e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 242.83 J/mol×K 273.00 Calculated Property
Cp,gas 324.02 J/mol×K 353.78 Calculated Property
Cp,gas 392.44 J/mol×K 434.56 Calculated Property
Cp,gas 449.84 J/mol×K 515.33 Calculated Property
Cp,gas 497.99 J/mol×K 596.11 Calculated Property
Cp,gas 538.63 J/mol×K 676.89 Calculated Property
Cp,gas 573.51 J/mol×K 757.67 Calculated Property
Cp,gas 604.40 J/mol×K 838.44 Calculated Property
Cp,gas 633.03 J/mol×K 919.22 Calculated Property
Cp,gas 661.16 J/mol×K 1000.00 Calculated Property

Similar Compounds

cis-Methyl 1,2-diphenylcyclopropane carboxylate. Cyclopentyl-hydroxy-phenyl-acetic acid 1-methyl-pyrrolidin-3-yl ester. azadirachtin. Noscapine. Moexipril desethyl 3Me (Moexprilate 3Me). 1H-pyrazolo[3,4-d]pyrimidine, 4-(methylthio)-1-beta-d-ribofuranosyl-, 2',3',5'-tribenzoate. N-Desmethylmirtazapine. Butorphanol di-TMS derivative. Moexipril Me. Poligodial + o-Tyr (ethyl ester) adduct (R,S), acetylated, # 1. Poligodial + o-Tyr (ethyl ester) adduct (R,S), acetylated, # 2. Leu-Trp, N-trimethylsilyl-, trimethylsilyl ester. risperidone. 1-Alpha-2-methyl-8-methoxy-6,7-methylenedioxy-1-(6,7-dimethoxy-3-phthalidyl)-1,2,3,4-tetrahydroisoquinoline. 1,2,3,4-Tetrahydroanthracene-cis-1,2-diol, ferrocenylboronate.

Find more compounds similar to Cyclopropanecarboxylic acid, 1,2-diphenyl-, methyl ester, trans-.

Sources

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