- InChI
- InChI=1S/C8H16O3/c1-5-11-7(10)6(9)8(2,3)4/h6,9H,5H2,1-4H3
- InChI Key
- LNSCMKSSQGPHCU-UHFFFAOYSA-N
- Formula
- C8H16O3
- SMILES
- CCOC(=O)C(O)C(C)(C)C
- Molecular Weight1
- 160.21
- 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).
- Inp : Non-polar retention indices.
- I : 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 |
|---|---|---|---|
| ΔfG° | -353.86 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -619.51 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 12.41 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 57.55 | kJ/mol | Joback Calculated Property |
| log10WS | -1.17 | Crippen Calculated Property | |
| logPoct/wat | 0.956 | Crippen Calculated Property | |
| McVol | 136.890 | ml/mol | McGowan Calculated Property |
| Pc | 3015.64 | kPa | Joback Calculated Property |
| Inp | [1050.00; 1050.00] |
|
|
| Inp | 1050.00 | NIST | |
| Inp | 1050.00 | NIST | |
| I | 1469.00 | NIST | |
| Tboil | 547.24 | K | Joback Calculated Property |
| Tc | 728.02 | K | Joback Calculated Property |
| Tfus | 300.32 | K | Joback Calculated Property |
| Vc | 0.509 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [337.14; 398.91] | J/mol×K | [547.24; 728.02] |
|
| Cp,gas | 337.14 | J/mol×K | 547.24 | Joback Calculated Property |
| Cp,gas | 348.80 | J/mol×K | 577.37 | Joback Calculated Property |
| Cp,gas | 359.89 | J/mol×K | 607.50 | Joback Calculated Property |
| Cp,gas | 370.42 | J/mol×K | 637.63 | Joback Calculated Property |
| Cp,gas | 380.43 | J/mol×K | 667.76 | Joback Calculated Property |
| Cp,gas | 389.92 | J/mol×K | 697.89 | Joback Calculated Property |
| Cp,gas | 398.91 | J/mol×K | 728.02 | Joback Calculated Property |
| η | [0.0000979; 0.0169327] | Pa×s | [300.32; 547.24] |
|
| η | 0.0169327 | Pa×s | 300.32 | Joback Calculated Property |
| η | 0.0042752 | Pa×s | 341.47 | Joback Calculated Property |
| η | 0.0014513 | Pa×s | 382.63 | Joback Calculated Property |
| η | 0.0006077 | Pa×s | 423.78 | Joback Calculated Property |
| η | 0.0002969 | Pa×s | 464.93 | Joback Calculated Property |
| η | 0.0001629 | Pa×s | 506.09 | Joback Calculated Property |
| η | 0.0000979 | Pa×s | 547.24 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Ethyl 2-hydroxy-3,3-dimethylbutyrate.
Sources
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