- InChI
- InChI=1S/C13H16O3/c1-5-16-13(15)12(14)11-9(3)6-8(2)7-10(11)4/h6-7H,5H2,1-4H3
- InChI Key
- XRSPPFOBPRPYLD-UHFFFAOYSA-N
- Formula
- C13H16O3
- SMILES
- CCOC(=O)C(=O)c1c(C)cc(C)cc1C
- Molecular Weight1
- 220.26
- CAS
- 5524-57-2
- 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).
- 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 | 0.6650 | Relay (... Calculated Property | |
| ΔfG° | -220.74 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -484.35 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 26.69 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 78.01 | kJ/mol | Relay (... Calculated Property |
| IE | 8.34 | eV | Relay (... Calculated Property |
| log10WS | -3.51 | Relay (... Calculated Property | |
| logPoct/wat | 2.358 | Crippen Calculated Property | |
| McVol | 179.280 | ml/mol | McGowan Calculated Property |
| Pc | 2331.52 | kPa | Joback Calculated Property |
| Tboil | 565.80 | K | Relay (... Calculated Property |
| Tc | 769.56 | K | Relay (... Calculated Property |
| Tfus | 305.25 | K | Relay (... Calculated Property |
| Vc | 0.659 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [460.01; 531.27] | J/mol×K | [668.62; 881.13] | 
|
| Cp,gas | 460.01 | J/mol×K | 668.62 | Joback Calculated Property |
| Cp,gas | 473.87 | J/mol×K | 704.04 | Joback Calculated Property |
| Cp,gas | 486.94 | J/mol×K | 739.46 | Joback Calculated Property |
| Cp,gas | 499.20 | J/mol×K | 774.87 | Joback Calculated Property |
| Cp,gas | 510.67 | J/mol×K | 810.29 | Joback Calculated Property |
| Cp,gas | 521.36 | J/mol×K | 845.71 | Joback Calculated Property |
| Cp,gas | 531.27 | J/mol×K | 881.13 | Joback Calculated Property |
| η | [0.0001682; 0.0009870] | Pa×s | [422.34; 668.62] |
|
| η | 0.0009870 | Pa×s | 422.34 | Joback Calculated Property |
| η | 0.0006450 | Pa×s | 463.39 | Joback Calculated Property |
| η | 0.0004517 | Pa×s | 504.43 | Joback Calculated Property |
| η | 0.0003337 | Pa×s | 545.48 | Joback Calculated Property |
| η | 0.0002573 | Pa×s | 586.53 | Joback Calculated Property |
| η | 0.0002052 | Pa×s | 627.57 | Joback Calculated Property |
| η | 0.0001682 | Pa×s | 668.62 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Ethyl mesitylglyoxylate.
Sources
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