- InChI
- InChI=1S/C27H44O4/c1-6-7-8-9-10-11-12-13-14-17-20-30-26(28)23-18-15-16-19-24(23)27(29)31-25(21(2)3)22(4)5/h15-16,18-19,21-22,25H,6-14,17,20H2,1-5H3
- InChI Key
- SKVWVZAAEKKUJI-UHFFFAOYSA-N
- Formula
- C27H44O4
- SMILES
-
CCCCCCCCCCCCOC(=O)c1ccccc1C(=O
)OC(C(C)C)C(C)C - Molecular Weight1
- 432.64
- 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° | -195.92 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -880.99 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 54.34 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 95.78 | kJ/mol | Joback Calculated Property |
| log10WS | -8.70 | Crippen Calculated Property | |
| logPoct/wat | 7.602 | Crippen Calculated Property | |
| McVol | 382.410 | ml/mol | McGowan Calculated Property |
| Pc | 876.36 | kPa | Joback Calculated Property |
| Inp | [2901.00; 2901.00] |
|
|
| Inp | 2901.00 | NIST | |
| Inp | 2901.00 | NIST | |
| Tboil | 1000.08 | K | Joback Calculated Property |
| Tc | 1224.77 | K | Joback Calculated Property |
| Tfus | 532.31 | K | Joback Calculated Property |
| Vc | 1.470 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1307.41; 1388.88] | J/mol×K | [1000.08; 1224.77] |
|
| Cp,gas | 1307.41 | J/mol×K | 1000.08 | Joback Calculated Property |
| Cp,gas | 1324.96 | J/mol×K | 1037.53 | Joback Calculated Property |
| Cp,gas | 1340.85 | J/mol×K | 1074.98 | Joback Calculated Property |
| Cp,gas | 1355.13 | J/mol×K | 1112.42 | Joback Calculated Property |
| Cp,gas | 1367.86 | J/mol×K | 1149.87 | Joback Calculated Property |
| Cp,gas | 1379.09 | J/mol×K | 1187.32 | Joback Calculated Property |
| Cp,gas | 1388.88 | J/mol×K | 1224.77 | Joback Calculated Property |
| η | [0.0000147; 0.0003750] | Pa×s | [532.31; 1000.08] |
|
| η | 0.0003750 | Pa×s | 532.31 | Joback Calculated Property |
| η | 0.0001549 | Pa×s | 610.27 | Joback Calculated Property |
| η | 0.0000781 | Pa×s | 688.23 | Joback Calculated Property |
| η | 0.0000453 | Pa×s | 766.19 | Joback Calculated Property |
| η | 0.0000291 | Pa×s | 844.16 | Joback Calculated Property |
| η | 0.0000201 | Pa×s | 922.12 | Joback Calculated Property |
| η | 0.0000147 | Pa×s | 1000.08 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Phthalic acid, 2,4-dimethylpent-3-yl dodecyl ester.
Sources
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