- InChI
- InChI=1S/C6H10O3/c1-3-9-6(8)5(2)4-7/h4,7H,3H2,1-2H3/b5-4+
- InChI Key
- UPWSFLJBKRQKBD-SNAWJCMRSA-N
- Formula
- C6H10O3
- SMILES
- CCOC(=O)C(C)=CO
- Molecular Weight1
- 130.14
- CAS
- 54843-13-9
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- 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).
- 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 | 0.5700 | Relay (1.0) Calculated Property | |
| ΔfG° | -299.43 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -602.02 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 17.06 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 60.92 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.23 | eV | Relay (1.0) Calculated Property |
| log10WS | -0.53 | Relay (1.0) Calculated Property | |
| logPoct/wat | 1.011 | Crippen Calculated Property | |
| McVol | 104.410 | ml/mol | McGowan Calculated Property |
| Pc | 3911.14 | kPa | Joback Calculated Property |
| Tboil | 465.85 | K | Relay (1.0) Calculated Property |
| Tc | 646.04 | K | Relay (1.0) Calculated Property |
| Tfus | 274.25 | K | Relay (1.0) Calculated Property |
| Vc | 0.383 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [227.19; 272.45] | J/mol×K | [509.19; 690.58] | 
|
| Cp,gas | 227.19 | J/mol×K | 509.19 | Joback Calculated Property |
| Cp,gas | 235.61 | J/mol×K | 539.42 | Joback Calculated Property |
| Cp,gas | 243.67 | J/mol×K | 569.65 | Joback Calculated Property |
| Cp,gas | 251.38 | J/mol×K | 599.88 | Joback Calculated Property |
| Cp,gas | 258.74 | J/mol×K | 630.12 | Joback Calculated Property |
| Cp,gas | 265.76 | J/mol×K | 660.35 | Joback Calculated Property |
| Cp,gas | 272.45 | J/mol×K | 690.58 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-Propenoic acid, 3-hydroxy-2-methyl-, ethyl ester.
Sources
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