- InChI
- InChI=1S/C12H14O2/c1-8-5-9(2)7-11(6-8)14-12(13)10-3-4-10/h5-7,10H,3-4H2,1-2H3
- InChI Key
- TYGXPZHSCQEDFV-UHFFFAOYSA-N
- Formula
- C12H14O2
- SMILES
- Cc1cc(C)cc(OC(=O)C2CC2)c1
- Molecular Weight1
- 190.24
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- IE : Ionization energy (eV).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- Inp : Non-polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Vc : Critical Volume (m3/kmol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ω | 0.5790 | Relay (... Calculated Property | |
| ΔfG° | -29.86 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -299.73 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 21.02 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 68.15 | kJ/mol | Relay (... Calculated Property |
| IE | 8.46 | eV | Relay (... Calculated Property |
| log10WS | -3.56 | Relay (... Calculated Property | |
| logPoct/wat | 2.619 | Crippen Calculated Property | |
| McVol | 152.760 | ml/mol | McGowan Calculated Property |
| Pc | 2790.61 | kPa | Joback Calculated Property |
| Inp | 1487.00 | NIST | |
| Tboil | 540.01 | K | Relay (... Calculated Property |
| Tc | 781.76 | K | Relay (... Calculated Property |
| Tfus | 308.91 | K | Relay (... Calculated Property |
| Vc | 0.577 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [378.84; 457.06] | J/mol×K | [593.63; 816.63] | 
|
| Cp,gas | 378.84 | J/mol×K | 593.63 | Joback Calculated Property |
| Cp,gas | 394.12 | J/mol×K | 630.80 | Joback Calculated Property |
| Cp,gas | 408.45 | J/mol×K | 667.96 | Joback Calculated Property |
| Cp,gas | 421.86 | J/mol×K | 705.13 | Joback Calculated Property |
| Cp,gas | 434.40 | J/mol×K | 742.30 | Joback Calculated Property |
| Cp,gas | 446.12 | J/mol×K | 779.46 | Joback Calculated Property |
| Cp,gas | 457.06 | J/mol×K | 816.63 | Joback Calculated Property |
| η | [0.0004175; 0.0014969] | Pa×s | [366.56; 593.63] |
|
| η | 0.0014969 | Pa×s | 366.56 | Joback Calculated Property |
| η | 0.0010952 | Pa×s | 404.40 | Joback Calculated Property |
| η | 0.0008454 | Pa×s | 442.25 | Joback Calculated Property |
| η | 0.0006797 | Pa×s | 480.10 | Joback Calculated Property |
| η | 0.0005642 | Pa×s | 517.94 | Joback Calculated Property |
| η | 0.0004804 | Pa×s | 555.78 | Joback Calculated Property |
| η | 0.0004175 | Pa×s | 593.63 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Cyclopropanecarboxylic acid, 3,5-dimethylphenyl ester.
Sources
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