- InChI
- InChI=1S/C15H24O6/c1-4-19-13(16)10-7-11(14(17)20-5-2)9-12(8-10)15(18)21-6-3/h10-12H,4-9H2,1-3H3/t10-,11-,12-
- InChI Key
- JQFXPGZFIFHJJV-AQHSTMNCSA-N
- Formula
- C15H24O6
- SMILES
-
CCOC(=O)C1CC(C(=O)OCC)CC(C(=O)
OCC)C1 - Molecular Weight1
- 300.35
- 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° | -617.31 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1073.69 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 36.94 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 76.26 | kJ/mol | Joback Calculated Property |
| log10WS | -1.86 | Crippen Calculated Property | |
| logPoct/wat | 1.708 | Crippen Calculated Property | |
| McVol | 233.670 | ml/mol | McGowan Calculated Property |
| Pc | 1763.93 | kPa | Joback Calculated Property |
| Inp | [1910.00; 1910.00] |
|
|
| Inp | 1910.00 | NIST | |
| Inp | 1910.00 | NIST | |
| Tboil | 781.68 | K | Joback Calculated Property |
| Tc | 985.04 | K | Joback Calculated Property |
| Tfus | 474.19 | K | Joback Calculated Property |
| Vc | 0.878 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [729.14; 810.05] | J/mol×K | [781.68; 985.04] |
|
| Cp,gas | 729.14 | J/mol×K | 781.68 | Joback Calculated Property |
| Cp,gas | 745.83 | J/mol×K | 815.57 | Joback Calculated Property |
| Cp,gas | 761.25 | J/mol×K | 849.47 | Joback Calculated Property |
| Cp,gas | 775.40 | J/mol×K | 883.36 | Joback Calculated Property |
| Cp,gas | 788.27 | J/mol×K | 917.25 | Joback Calculated Property |
| Cp,gas | 799.82 | J/mol×K | 951.15 | Joback Calculated Property |
| Cp,gas | 810.05 | J/mol×K | 985.04 | Joback Calculated Property |
| η | [0.0001288; 0.0009883] | Pa×s | [474.19; 781.68] |
|
| η | 0.0009883 | Pa×s | 474.19 | Joback Calculated Property |
| η | 0.0005963 | Pa×s | 525.44 | Joback Calculated Property |
| η | 0.0003936 | Pa×s | 576.69 | Joback Calculated Property |
| η | 0.0002780 | Pa×s | 627.93 | Joback Calculated Property |
| η | 0.0002069 | Pa×s | 679.18 | Joback Calculated Property |
| η | 0.0001606 | Pa×s | 730.43 | Joback Calculated Property |
| η | 0.0001288 | Pa×s | 781.68 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to trans-1,3,5-Cyclohexanetricarboxylic acid, triethyl ester.
Sources
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