- InChI
- InChI=1S/C12H12O7/c1-17-10(14)6-4-8(12(16)19-3)9(13)5-7(6)11(15)18-2/h4-5,13H,1-3H3
- InChI Key
- MHDSAMHNINKUGB-UHFFFAOYSA-N
- Formula
- C12H12O7
- SMILES
-
COC(=O)c1cc(C(=O)OC)c(C(=O)OC)
cc1O - Molecular Weight1
- 268.22
- 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° | -713.07 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -989.13 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 34.24 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 86.39 | kJ/mol | Joback Calculated Property |
| log10WS | -1.75 | Crippen Calculated Property | |
| logPoct/wat | 0.752 | Crippen Calculated Property | |
| McVol | 184.370 | ml/mol | McGowan Calculated Property |
| Pc | 3149.09 | kPa | Joback Calculated Property |
| Inp | 1899.00 | NIST | |
| Tboil | 820.09 | K | Joback Calculated Property |
| Tc | 1044.63 | K | Joback Calculated Property |
| Tfus | 604.66 | K | Joback Calculated Property |
| Vc | 0.637 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [516.90; 566.64] | J/mol×K | [820.09; 1044.63] | 
|
| Cp,gas | 516.90 | J/mol×K | 820.09 | Joback Calculated Property |
| Cp,gas | 527.02 | J/mol×K | 857.51 | Joback Calculated Property |
| Cp,gas | 536.38 | J/mol×K | 894.94 | Joback Calculated Property |
| Cp,gas | 545.01 | J/mol×K | 932.36 | Joback Calculated Property |
| Cp,gas | 552.92 | J/mol×K | 969.79 | Joback Calculated Property |
| Cp,gas | 560.12 | J/mol×K | 1007.21 | Joback Calculated Property |
| Cp,gas | 566.64 | J/mol×K | 1044.63 | Joback Calculated Property |
| η | [0.0000064; 0.0000558] | Pa×s | [604.66; 820.09] |
|
| η | 0.0000558 | Pa×s | 604.66 | Joback Calculated Property |
| η | 0.0000351 | Pa×s | 640.57 | Joback Calculated Property |
| η | 0.0000232 | Pa×s | 676.47 | Joback Calculated Property |
| η | 0.0000160 | Pa×s | 712.38 | Joback Calculated Property |
| η | 0.0000114 | Pa×s | 748.28 | Joback Calculated Property |
| η | 0.0000084 | Pa×s | 784.19 | Joback Calculated Property |
| η | 0.0000064 | Pa×s | 820.09 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzene-1,2,4-tricarboxylic acid, 5-hydroxy, trimethyl ester.
Sources
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