- InChI
- InChI=1S/C27H18O6/c28-25(31-22-10-4-1-5-11-22)19-16-20(26(29)32-23-12-6-2-7-13-23)18-21(17-19)27(30)33-24-14-8-3-9-15-24/h1-18H
- InChI Key
- ZNOKZTBEFWQAHD-UHFFFAOYSA-N
- Formula
- C27H18O6
- SMILES
-
O=C(Oc1ccccc1)c1cc(C(=O)Oc2ccc
cc2)cc(C(=O)Oc2ccccc2)c1 - Molecular Weight1
- 438.43
- CAS
- 7383-70-2
- Other Names
-
- Trimesic acid, triphenyl ester
- 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).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (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).
- 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 |
|---|---|---|---|
| ω | 1.0345 | Relay (1.0) Calculated Property | |
| ΔfG° | -324.27 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -562.55 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 54.18 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 133.27 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.45 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.80 | Relay (1.0) Calculated Property | |
| logPoct/wat | 5.344 | Crippen Calculated Property | |
| McVol | 318.570 | ml/mol | McGowan Calculated Property |
| Pc | 1598.72 | kPa | Joback Calculated Property |
| Tboil | 764.54 | K | Relay (1.0) Calculated Property |
| Tc | 1130.06 | K | Relay (1.0) Calculated Property |
| Tfus | 410.26 | K | Relay (1.0) Calculated Property |
| Vc | 1.162 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [974.60; 983.06] | J/mol×K | [1108.70; 1375.86] | 
|
| Cp,gas | 975.81 | J/mol×K | 1108.70 | Joback Calculated Property |
| Cp,gas | 980.14 | J/mol×K | 1153.23 | Joback Calculated Property |
| Cp,gas | 982.52 | J/mol×K | 1197.75 | Joback Calculated Property |
| Cp,gas | 983.06 | J/mol×K | 1242.28 | Joback Calculated Property |
| Cp,gas | 981.85 | J/mol×K | 1286.81 | Joback Calculated Property |
| Cp,gas | 979.00 | J/mol×K | 1331.33 | Joback Calculated Property |
| Cp,gas | 974.60 | J/mol×K | 1375.86 | Joback Calculated Property |
| η | [0.0000099; 0.0001282] | Pa×s | [651.76; 1108.70] |
|
| η | 0.0001282 | Pa×s | 651.76 | Joback Calculated Property |
| η | 0.0000669 | Pa×s | 727.92 | Joback Calculated Property |
| η | 0.0000395 | Pa×s | 804.07 | Joback Calculated Property |
| η | 0.0000255 | Pa×s | 880.23 | Joback Calculated Property |
| η | 0.0000177 | Pa×s | 956.39 | Joback Calculated Property |
| η | 0.0000129 | Pa×s | 1032.54 | Joback Calculated Property |
| η | 0.0000099 | Pa×s | 1108.70 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,3,5-Benzenetricarboxylic acid, triphenyl ester.
Sources
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