- InChI
- InChI=1S/C22H34O4/c1-9-17(21(3,4)5)25-19(23)15-13-11-12-14-16(15)20(24)26-18(10-2)22(6,7)8/h11-14,17-18H,9-10H2,1-8H3
- InChI Key
- OUAIKFCXUVPKPJ-UHFFFAOYSA-N
- Formula
- C22H34O4
- SMILES
-
CCC(OC(=O)c1ccccc1C(=O)OC(CC)C
(C)(C)C)C(C)(C)C - Molecular Weight1
- 362.50
- 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° | -229.90 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -790.01 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 30.09 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 82.45 | kJ/mol | Joback Calculated Property |
| log10WS | -6.72 | Crippen Calculated Property | |
| logPoct/wat | 5.650 | Crippen Calculated Property | |
| McVol | 311.960 | ml/mol | McGowan Calculated Property |
| Pc | 1215.74 | kPa | Joback Calculated Property |
| Inp | [1577.00; 1577.00] |
|
|
| Inp | 1577.00 | NIST | |
| Inp | 1577.00 | NIST | |
| Tboil | 879.66 | K | Joback Calculated Property |
| Tc | 1094.58 | K | Joback Calculated Property |
| Tfus | 495.80 | K | Joback Calculated Property |
| Vc | 1.173 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [999.41; 1084.14] | J/mol×K | [879.66; 1094.58] |
|
| Cp,gas | 999.41 | J/mol×K | 879.66 | Joback Calculated Property |
| Cp,gas | 1016.47 | J/mol×K | 915.48 | Joback Calculated Property |
| Cp,gas | 1032.26 | J/mol×K | 951.30 | Joback Calculated Property |
| Cp,gas | 1046.85 | J/mol×K | 987.12 | Joback Calculated Property |
| Cp,gas | 1060.31 | J/mol×K | 1022.94 | Joback Calculated Property |
| Cp,gas | 1072.71 | J/mol×K | 1058.76 | Joback Calculated Property |
| Cp,gas | 1084.14 | J/mol×K | 1094.58 | Joback Calculated Property |
| η | [0.0000210; 0.0005260] | Pa×s | [495.80; 879.66] |
|
| η | 0.0005260 | Pa×s | 495.80 | Joback Calculated Property |
| η | 0.0002264 | Pa×s | 559.78 | Joback Calculated Property |
| η | 0.0001158 | Pa×s | 623.75 | Joback Calculated Property |
| η | 0.0000671 | Pa×s | 687.73 | Joback Calculated Property |
| η | 0.0000427 | Pa×s | 751.71 | Joback Calculated Property |
| η | 0.0000291 | Pa×s | 815.68 | Joback Calculated Property |
| η | 0.0000210 | Pa×s | 879.66 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Phthalic acid, di(2,2-dimethylpent-3-yl) ester.
Sources
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