- InChI
- InChI=1S/C10H16O4/c1-5-14-9(13)7(11)6-8(12)10(2,3)4/h5-6H2,1-4H3
- InChI Key
- NIMKIMUBJFWPTD-UHFFFAOYSA-N
- Formula
- C10H16O4
- SMILES
- CCOC(=O)C(=O)CC(=O)C(C)(C)C
- Molecular Weight1
- 200.23
- CAS
- 13395-36-3
- Other Names
-
- Ethyl trimethylacetopyruvate
- ethyl 5,5-dimethyl-2,4-dioxohexanoate
- 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 | 0.5574 | Relay (1.0) Calculated Property | |
| ΔfG° | -455.60 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -782.01 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 20.23 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 64.32 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.03 | eV | Relay (1.0) Calculated Property |
| log10WS | -1.89 | Relay (1.0) Calculated Property | |
| logPoct/wat | 1.124 | Crippen Calculated Property | |
| McVol | 162.340 | ml/mol | McGowan Calculated Property |
| Pc | 2532.82 | kPa | Joback Calculated Property |
| Tboil | 502.50 | K | Relay (1.0) Calculated Property |
| Tc | 686.33 | K | Relay (1.0) Calculated Property |
| Tfus | 318.40 | K | Relay (1.0) Calculated Property |
| Vc | 0.593 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [412.19; 479.18] | J/mol×K | [609.00; 807.79] | 
|
| Cp,gas | 412.19 | J/mol×K | 609.00 | Joback Calculated Property |
| Cp,gas | 425.13 | J/mol×K | 642.13 | Joback Calculated Property |
| Cp,gas | 437.33 | J/mol×K | 675.26 | Joback Calculated Property |
| Cp,gas | 448.82 | J/mol×K | 708.40 | Joback Calculated Property |
| Cp,gas | 459.61 | J/mol×K | 741.53 | Joback Calculated Property |
| Cp,gas | 469.72 | J/mol×K | 774.66 | Joback Calculated Property |
| Cp,gas | 479.18 | J/mol×K | 807.79 | Joback Calculated Property |
| η | [0.0002157; 0.0023301] | Pa×s | [376.90; 609.00] |
|
| η | 0.0023301 | Pa×s | 376.90 | Joback Calculated Property |
| η | 0.0013031 | Pa×s | 415.58 | Joback Calculated Property |
| η | 0.0008046 | Pa×s | 454.27 | Joback Calculated Property |
| η | 0.0005358 | Pa×s | 492.95 | Joback Calculated Property |
| η | 0.0003786 | Pa×s | 531.63 | Joback Calculated Property |
| η | 0.0002804 | Pa×s | 570.32 | Joback Calculated Property |
| η | 0.0002157 | Pa×s | 609.00 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Hexanoic acid, 5,5-dimethyl-2,4-dioxo-, ethyl ester.
Sources
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