- InChI
- InChI=1S/C12H20O7/c1-4-17-9(13)7-12(16,11(15)19-6-3)8-10(14)18-5-2/h16H,4-8H2,1-3H3
- InChI Key
- DOOTYTYQINUNNV-UHFFFAOYSA-N
- Formula
- C12H20O7
- SMILES
-
CCOC(=O)CC(O)(CC(=O)OCC)C(=O)O
CC - Molecular Weight1
- 276.28
- CAS
- 77-93-0
- Other Names
-
- 1,2,3-Propanetricarboxylic acid, 2-hydroxy-, 1,2,3-triethyl ester
- 1,2,3-propanetricarboxylic acid, 2-hydroxy-, triethyl ester
- 2-Hydroxy-1,2,3-propanetricarboxylic acid, triethyl ester
- Citroflex 2
- Crodamol TC
- Eudraflex
- Hydagen C.A.T
- Hydragen CAT
- NSC 8907
- TEC
- Triethyl 2-hydroxy-1,2,3-propanetricarboxylate
- Triethylester kyseliny citronove
- Uniflex TEC
- Uniplex 80
- citric acid, triethyl ester
- ethyl citrate
- 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).
- ΔfH°solid : Solid phase 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).
- ΔvapH : Enthalpy of vaporization at a given temperature (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).
- ρl : Liquid Density (kg/m3).
- Inp : Non-polar retention indices.
- I : Polar retention indices.
- 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 |
|---|---|---|---|
| ω | 0.9033 | Relay (1.0) Calculated Property | |
| η | 0.0321000 | Pa×s | Solubilities and Thermodynamic Properties of Carbon Dioxide in Some Biobased Solvents |
| ΔfG° | -785.58 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1419.07 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfH°solid | -1492.00 | kJ/mol | NIST |
| ΔfusH° | 31.87 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 83.55 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.69 | eV | Relay (1.0) Calculated Property |
| log10WS | -0.86 | Relay (1.0) Calculated Property | |
| logPoct/wat | 0.187 | Crippen Calculated Property | |
| McVol | 208.130 | ml/mol | McGowan Calculated Property |
| Pc | 2222.89 | kPa | Joback Calculated Property |
| Inp | [1627.00; 1659.40] |
|
|
| Inp | 1655.00 | NIST | |
| Inp | 1659.40 | NIST | |
| Inp | 1656.00 | NIST | |
| Inp | 1659.00 | NIST | |
| Inp | Outlier 1627.00 | NIST | |
| Inp | 1655.00 | NIST | |
| Inp | 1659.40 | NIST | |
| I | [2461.00; 2461.00] |
|
|
| I | 2461.00 | NIST | |
| I | 2461.00 | NIST | |
| Tboil | 567.20 | K | NIST |
| Tc | 755.93 | K | Relay (1.0) Calculated Property |
| Tfus | 295.29 | K | Relay (1.0) Calculated Property |
| Vc | 0.780 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [620.61; 677.08] | J/mol×K | [791.78; 981.50] |
|
| Cp,gas | 620.61 | J/mol×K | 791.78 | Joback Calculated Property |
| Cp,gas | 631.95 | J/mol×K | 823.40 | Joback Calculated Property |
| Cp,gas | 642.51 | J/mol×K | 855.02 | Joback Calculated Property |
| Cp,gas | 652.30 | J/mol×K | 886.64 | Joback Calculated Property |
| Cp,gas | 661.32 | J/mol×K | 918.26 | Joback Calculated Property |
| Cp,gas | 669.58 | J/mol×K | 949.88 | Joback Calculated Property |
| Cp,gas | 677.08 | J/mol×K | 981.50 | Joback Calculated Property |
| η | [0.0000167; 0.0004247] | Pa×s | [504.72; 791.78] |
|
| η | 0.0004247 | Pa×s | 504.72 | Joback Calculated Property |
| η | 0.0001961 | Pa×s | 552.56 | Joback Calculated Property |
| η | 0.0001024 | Pa×s | 600.41 | Joback Calculated Property |
| η | 0.0000588 | Pa×s | 648.25 | Joback Calculated Property |
| η | 0.0000365 | Pa×s | 696.09 | Joback Calculated Property |
| η | 0.0000241 | Pa×s | 743.94 | Joback Calculated Property |
| η | 0.0000167 | Pa×s | 791.78 | Joback Calculated Property |
| ΔvapH | 68.20 | kJ/mol | 473.50 | NIST |
| ρl | [1097.30; 1138.40] | kg/m3 | [293.15; 338.15] |
|
| ρl | 1138.40 | kg/m3 | 293.15 | Investigation of SO2 solubilities in some biobased solvents and their thermodynamic properties |
| ρl | 1134.50 | kg/m3 | 298.15 | Investigation of SO2 solubilities in some biobased solvents and their thermodynamic properties |
| ρl | 1131.10 | kg/m3 | 303.15 | Investigation of SO2 solubilities in some biobased solvents and their thermodynamic properties |
| ρl | 1126.20 | kg/m3 | 308.15 | Investigation of SO2 solubilities in some biobased solvents and their thermodynamic properties |
| ρl | 1122.40 | kg/m3 | 313.15 | Investigation of SO2 solubilities in some biobased solvents and their thermodynamic properties |
| ρl | 1116.50 | kg/m3 | 318.15 | Investigation of SO2 solubilities in some biobased solvents and their thermodynamic properties |
| ρl | 1112.10 | kg/m3 | 323.15 | Investigation of SO2 solubilities in some biobased solvents and their thermodynamic properties |
| ρl | 1106.60 | kg/m3 | 328.15 | Investigation of SO2 solubilities in some biobased solvents and their thermodynamic properties |
| ρl | 1102.80 | kg/m3 | 333.15 | Investigation of SO2 solubilities in some biobased solvents and their thermodynamic properties |
| ρl | 1097.30 | kg/m3 | 338.15 | Investigation of SO2 solubilities in some biobased solvents and their thermodynamic properties |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 400.20 | K | 0.10 | NIST |
Similar Compounds
Find more compounds similar to Triethyl citrate.
Mixtures
Sources
- Cheméo Relay (1.0)
- Crippen Method
- Crippen Method
- Investigation of SO2 solubilities in some biobased solvents and their thermodynamic properties
- Solubilities and Thermodynamic Properties of Carbon Dioxide in Some Biobased Solvents
- Synthesis and Characterization of Diethyl Citrate and Phase Equilibria in Mixtures with Ethanol and Water
- Joback Method
- McGowan Method
- NIST Webbook
Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more.
Take the time to validate and double check the source of the data.
Outlier This icon means
that the value is more than 2 standard deviations away from the
property mean.