- InChI
- InChI=1S/C10H16O6/c1-6(9(12)15-3)7(10(13)16-4)5-8(11)14-2/h6-7H,5H2,1-4H3
- InChI Key
- QJJJDRPIBYWIHG-UHFFFAOYSA-N
- Formula
- C10H16O6
- SMILES
- COC(=O)CC(C(=O)OC)C(C)C(=O)OC
- Molecular Weight1
- 232.23
- 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.
- 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° | -673.32 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -994.69 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 22.97 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 64.55 | kJ/mol | Joback Calculated Property |
| log10WS | -0.11 | Crippen Calculated Property | |
| logPoct/wat | 0.148 | Crippen Calculated Property | |
| McVol | 174.080 | ml/mol | McGowan Calculated Property |
| Pc | 2441.06 | kPa | Joback Calculated Property |
| Inp | 1435.00 | NIST | |
| Tboil | 656.19 | K | Joback Calculated Property |
| Tc | 849.21 | K | Joback Calculated Property |
| Tfus | 388.94 | K | Joback Calculated Property |
| Vc | 0.655 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [460.00; 525.69] | J/mol×K | [656.19; 849.21] | 
|
| Cp,gas | 460.00 | J/mol×K | 656.19 | Joback Calculated Property |
| Cp,gas | 472.62 | J/mol×K | 688.36 | Joback Calculated Property |
| Cp,gas | 484.60 | J/mol×K | 720.53 | Joback Calculated Property |
| Cp,gas | 495.91 | J/mol×K | 752.70 | Joback Calculated Property |
| Cp,gas | 506.54 | J/mol×K | 784.87 | Joback Calculated Property |
| Cp,gas | 516.47 | J/mol×K | 817.04 | Joback Calculated Property |
| Cp,gas | 525.69 | J/mol×K | 849.21 | Joback Calculated Property |
| η | [0.0001289; 0.0016466] | Pa×s | [388.94; 656.19] |
|
| η | 0.0016466 | Pa×s | 388.94 | Joback Calculated Property |
| η | 0.0008660 | Pa×s | 433.48 | Joback Calculated Property |
| η | 0.0005133 | Pa×s | 478.02 | Joback Calculated Property |
| η | 0.0003327 | Pa×s | 522.57 | Joback Calculated Property |
| η | 0.0002308 | Pa×s | 567.11 | Joback Calculated Property |
| η | 0.0001689 | Pa×s | 611.65 | Joback Calculated Property |
| η | 0.0001289 | Pa×s | 656.19 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Trimethyl isocitrate.
Sources
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