- InChI
- InChI=1S/C26H26O4/c1-17(2)21-12-5-7-14-23(21)29-25(27)19-10-9-11-20(16-19)26(28)30-24-15-8-6-13-22(24)18(3)4/h5-18H,1-4H3
- InChI Key
- JNEANCAZOPNWOB-UHFFFAOYSA-N
- Formula
- C26H26O4
- SMILES
-
CC(C)c1ccccc1OC(=O)c1cccc(C(=O
)Oc2ccccc2C(C)C)c1 - Molecular Weight1
- 402.48
- 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° | 3.66 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -404.95 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 42.58 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 99.82 | kJ/mol | Joback Calculated Property |
| log10WS | -8.02 | Crippen Calculated Property | |
| logPoct/wat | 6.372 | Crippen Calculated Property | |
| McVol | 320.800 | ml/mol | McGowan Calculated Property |
| Pc | 1415.44 | kPa | Joback Calculated Property |
| Inp | [3127.00; 3127.00] |
|
|
| Inp | 3127.00 | NIST | |
| Inp | 3127.00 | NIST | |
| Tboil | 1040.96 | K | Joback Calculated Property |
| Tc | 1290.06 | K | Joback Calculated Property |
| Tfus | 613.92 | K | Joback Calculated Property |
| Vc | 1.204 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1025.26; 1072.03] | J/mol×K | [1040.96; 1290.06] |
|
| Cp,gas | 1025.26 | J/mol×K | 1040.96 | Joback Calculated Property |
| Cp,gas | 1036.89 | J/mol×K | 1082.48 | Joback Calculated Property |
| Cp,gas | 1046.89 | J/mol×K | 1123.99 | Joback Calculated Property |
| Cp,gas | 1055.33 | J/mol×K | 1165.51 | Joback Calculated Property |
| Cp,gas | 1062.29 | J/mol×K | 1207.03 | Joback Calculated Property |
| Cp,gas | 1067.83 | J/mol×K | 1248.55 | Joback Calculated Property |
| Cp,gas | 1072.03 | J/mol×K | 1290.06 | Joback Calculated Property |
| η | [0.0000214; 0.0002246] | Pa×s | [613.92; 1040.96] |
|
| η | 0.0002246 | Pa×s | 613.92 | Joback Calculated Property |
| η | 0.0001239 | Pa×s | 685.09 | Joback Calculated Property |
| η | 0.0000764 | Pa×s | 756.27 | Joback Calculated Property |
| η | 0.0000512 | Pa×s | 827.44 | Joback Calculated Property |
| η | 0.0000366 | Pa×s | 898.61 | Joback Calculated Property |
| η | 0.0000274 | Pa×s | 969.79 | Joback Calculated Property |
| η | 0.0000214 | Pa×s | 1040.96 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Isophthalic acid, di(2-isopropylphenyl) ester.
Sources
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