- InChI
- InChI=1S/C11H18O6/c1-4-15-9(12)7-8(10(13)16-5-2)11(14)17-6-3/h8H,4-7H2,1-3H3
- InChI Key
- TVWZLLYAJDSSCJ-UHFFFAOYSA-N
- Formula
- C11H18O6
- SMILES
- CCOC(=O)CC(C(=O)OCC)C(=O)OCC
- Molecular Weight1
- 246.26
- CAS
- 7459-46-3
- Other Names
-
- Ethane-1,1,2-tricarboxylic acid, triethyl ester
- Triethyl ethane tricarboxylate
- Triethyl ethane-1,2,2-tricarboxylate
- 1,1,2-Tricarbethoxyethane
- Triethyl 1,1,2-ethanetricarboxylate
- triethyl ethane-1,1,2-tricarboxylate
- 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).
- Tboilr : Boiling point at reduced pressure (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° | -662.46 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1010.05 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 29.08 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 67.16 | kJ/mol | Joback Calculated Property |
| log10WS | -0.77 | Crippen Calculated Property | |
| logPoct/wat | 0.682 | Crippen Calculated Property | |
| McVol | 188.170 | ml/mol | McGowan Calculated Property |
| Pc | 2208.29 | kPa | Joback Calculated Property |
| Tboil | 679.51 | K | Joback Calculated Property |
| Tc | 867.80 | K | Joback Calculated Property |
| Tfus | 415.21 | K | Joback Calculated Property |
| Vc | 0.718 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [510.77; 578.31] | J/mol×K | [679.51; 867.80] | 
|
| Cp,gas | 510.77 | J/mol×K | 679.51 | Joback Calculated Property |
| Cp,gas | 523.76 | J/mol×K | 710.89 | Joback Calculated Property |
| Cp,gas | 536.07 | J/mol×K | 742.27 | Joback Calculated Property |
| Cp,gas | 547.70 | J/mol×K | 773.66 | Joback Calculated Property |
| Cp,gas | 558.62 | J/mol×K | 805.04 | Joback Calculated Property |
| Cp,gas | 568.83 | J/mol×K | 836.42 | Joback Calculated Property |
| Cp,gas | 578.31 | J/mol×K | 867.80 | Joback Calculated Property |
| η | [0.0001226; 0.0012616] | Pa×s | [415.21; 679.51] |
|
| η | 0.0012616 | Pa×s | 415.21 | Joback Calculated Property |
| η | 0.0007099 | Pa×s | 459.26 | Joback Calculated Property |
| η | 0.0004418 | Pa×s | 503.31 | Joback Calculated Property |
| η | 0.0002968 | Pa×s | 547.36 | Joback Calculated Property |
| η | 0.0002115 | Pa×s | 591.41 | Joback Calculated Property |
| η | 0.0001580 | Pa×s | 635.46 | Joback Calculated Property |
| η | 0.0001226 | Pa×s | 679.51 | Joback Calculated Property |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 372.20 | K | 0.07 | NIST |
Similar Compounds
Find more compounds similar to 1,1,2-Ethanetricarboxylic acid, triethyl ester.
Sources
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