- InChI
- InChI=1S/C24H20O6/c25-22(28-19-12-6-2-7-13-19)16-21(30-24(27)18-10-4-1-5-11-18)17-23(26)29-20-14-8-3-9-15-20/h1-15,21H,16-17H2
- InChI Key
- CEIXSUMKBRIAAH-UHFFFAOYSA-N
- Formula
- C24H20O6
- SMILES
-
O=C(CC(CC(=O)Oc1ccccc1)OC(=O)c
1ccccc1)Oc1ccccc1 - Molecular Weight1
- 404.41
- 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).
- 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° | -215.77 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -568.78 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 44.88 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 102.93 | kJ/mol | Joback Calculated Property |
| log10WS | -5.75 | Crippen Calculated Property | |
| logPoct/wat | 4.203 | Crippen Calculated Property | |
| McVol | 300.060 | ml/mol | McGowan Calculated Property |
| Pc | 1760.97 | kPa | Joback Calculated Property |
| Tboil | 1056.99 | K | Joback Calculated Property |
| Tc | 1309.45 | K | Joback Calculated Property |
| Tfus | 640.98 | K | Joback Calculated Property |
| Vc | 1.121 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [939.18; 966.36] | J/mol×K | [1056.99; 1309.45] | 
|
| Cp,gas | 939.18 | J/mol×K | 1056.99 | Joback Calculated Property |
| Cp,gas | 947.60 | J/mol×K | 1099.07 | Joback Calculated Property |
| Cp,gas | 954.36 | J/mol×K | 1141.14 | Joback Calculated Property |
| Cp,gas | 959.55 | J/mol×K | 1183.22 | Joback Calculated Property |
| Cp,gas | 963.23 | J/mol×K | 1225.30 | Joback Calculated Property |
| Cp,gas | 965.48 | J/mol×K | 1267.37 | Joback Calculated Property |
| Cp,gas | 966.36 | J/mol×K | 1309.45 | Joback Calculated Property |
| η | [0.0000203; 0.0002110] | Pa×s | [640.98; 1056.99] |
|
| η | 0.0002110 | Pa×s | 640.98 | Joback Calculated Property |
| η | 0.0001181 | Pa×s | 710.32 | Joback Calculated Property |
| η | 0.0000732 | Pa×s | 779.65 | Joback Calculated Property |
| η | 0.0000491 | Pa×s | 848.99 | Joback Calculated Property |
| η | 0.0000350 | Pa×s | 918.32 | Joback Calculated Property |
| η | 0.0000261 | Pa×s | 987.65 | Joback Calculated Property |
| η | 0.0000203 | Pa×s | 1056.99 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glycerol tribenzoate.
Sources
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