- InChI
- InChI=1S/C10H18O3/c1-6-13-9(12)10(4,5)8(11)7(2)3/h7H,6H2,1-5H3
- InChI Key
- IINVHMMMAUHNDG-UHFFFAOYSA-N
- Formula
- C10H18O3
- SMILES
- CCOC(=O)C(C)(C)C(=O)C(C)C
- Molecular Weight1
- 186.25
- CAS
- 4447-64-7
- 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).
- 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 |
|---|---|---|---|
| ΔfG° | -329.12 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -621.14 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 15.11 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 52.07 | kJ/mol | Joback Calculated Property |
| log10WS | -1.67 | Crippen Calculated Property | |
| logPoct/wat | 1.801 | Crippen Calculated Property | |
| McVol | 160.770 | ml/mol | McGowan Calculated Property |
| Pc | 2398.22 | kPa | Joback Calculated Property |
| Tboil | 554.69 | K | Joback Calculated Property |
| Tc | 749.62 | K | Joback Calculated Property |
| Tfus | 311.97 | K | Joback Calculated Property |
| Vc | 0.609 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [393.82; 469.81] | J/mol×K | [554.69; 749.62] | 
|
| Cp,gas | 393.82 | J/mol×K | 554.69 | Joback Calculated Property |
| Cp,gas | 408.31 | J/mol×K | 587.18 | Joback Calculated Property |
| Cp,gas | 422.04 | J/mol×K | 619.67 | Joback Calculated Property |
| Cp,gas | 435.03 | J/mol×K | 652.15 | Joback Calculated Property |
| Cp,gas | 447.31 | J/mol×K | 684.64 | Joback Calculated Property |
| Cp,gas | 458.90 | J/mol×K | 717.13 | Joback Calculated Property |
| Cp,gas | 469.81 | J/mol×K | 749.62 | Joback Calculated Property |
| η | [0.0002047; 0.0041458] | Pa×s | [311.97; 554.69] |
|
| η | 0.0041458 | Pa×s | 311.97 | Joback Calculated Property |
| η | 0.0018831 | Pa×s | 352.42 | Joback Calculated Property |
| η | 0.0010063 | Pa×s | 392.88 | Joback Calculated Property |
| η | 0.0006045 | Pa×s | 433.33 | Joback Calculated Property |
| η | 0.0003961 | Pa×s | 473.78 | Joback Calculated Property |
| η | 0.0002774 | Pa×s | 514.24 | Joback Calculated Property |
| η | 0.0002047 | Pa×s | 554.69 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2,2,4-Trimethyl-3-oxovaleric acid, ethyl ester.
Sources
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