- InChI
- InChI=1S/C12H14O2/c1-4-10-6-5-7-11(8-10)14-12(13)9(2)3/h5-8H,2,4H2,1,3H3
- InChI Key
- JYBRWFGZBXMHSO-UHFFFAOYSA-N
- Formula
- C12H14O2
- SMILES
- C=C(C)C(=O)Oc1cccc(CC)c1
- Molecular Weight1
- 190.24
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- 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).
- 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 | 0.5731 | Relay (1.0) Calculated Property | |
| ΔfH°gas | -269.43 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 22.27 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 67.22 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.59 | eV | Relay (1.0) Calculated Property |
| logPoct/wat | 2.730 | Crippen Calculated Property | |
| McVol | 159.320 | ml/mol | McGowan Calculated Property |
| Pc | 2495.01 | kPa | Joback Calculated Property |
| Inp | 1436.00 | NIST | |
| Tboil | 511.37 | K | Relay (1.0) Calculated Property |
| Tc | 740.60 | K | Relay (1.0) Calculated Property |
| Tfus | 248.84 | K | Relay (1.0) Calculated Property |
| Vc | 0.583 | m3/kmol | Relay (1.0) Calculated Property |
Cheméo can also estimate Standard Gibbs free energy of formation, 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 | [368.77; 445.05] | J/mol×K | [560.60; 773.18] | 
|
| Cp,gas | 368.77 | J/mol×K | 560.60 | Joback Calculated Property |
| Cp,gas | 383.63 | J/mol×K | 596.03 | Joback Calculated Property |
| Cp,gas | 397.60 | J/mol×K | 631.46 | Joback Calculated Property |
| Cp,gas | 410.70 | J/mol×K | 666.89 | Joback Calculated Property |
| Cp,gas | 422.96 | J/mol×K | 702.32 | Joback Calculated Property |
| Cp,gas | 434.40 | J/mol×K | 737.75 | Joback Calculated Property |
| Cp,gas | 445.05 | J/mol×K | 773.18 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Methacrylic acid, 3-ethylphenyl ester.
Sources
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