- InChI
- InChI=1S/C25H40O4/c1-6-7-8-9-10-11-12-15-18-28-24(26)21-16-13-14-17-22(21)25(27)29-23(19(2)3)20(4)5/h13-14,16-17,19-20,23H,6-12,15,18H2,1-5H3
- InChI Key
- OEDMKLVJTYWPEO-UHFFFAOYSA-N
- Formula
- C25H40O4
- SMILES
-
CCCCCCCCCCOC(=O)c1ccccc1C(=O)O
C(C(C)C)C(C)C - Molecular Weight1
- 404.58
- 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).
- 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 |
|---|---|---|---|
| ω | 1.0772 | Relay (... Calculated Property | |
| ΔfG° | -212.76 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -932.14 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 49.16 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 105.20 | kJ/mol | Relay (... Calculated Property |
| IE | 9.17 | eV | Relay (... Calculated Property |
| log10WS | -6.84 | Relay (... Calculated Property | |
| logPoct/wat | 6.822 | Crippen Calculated Property | |
| McVol | 354.230 | ml/mol | McGowan Calculated Property |
| Pc | 985.16 | kPa | Joback Calculated Property |
| Inp | 2699.00 | NIST | |
| Tboil | 660.59 | K | Relay (... Calculated Property |
| Tc | 867.82 | K | Relay (... Calculated Property |
| Tfus | 271.79 | K | Relay (... Calculated Property |
| Vc | 1.302 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1182.51; 1264.15] | J/mol×K | [954.32; 1169.03] | 
|
| Cp,gas | 1182.51 | J/mol×K | 954.32 | Joback Calculated Property |
| Cp,gas | 1199.70 | J/mol×K | 990.10 | Joback Calculated Property |
| Cp,gas | 1215.40 | J/mol×K | 1025.89 | Joback Calculated Property |
| Cp,gas | 1229.65 | J/mol×K | 1061.67 | Joback Calculated Property |
| Cp,gas | 1242.50 | J/mol×K | 1097.46 | Joback Calculated Property |
| Cp,gas | 1253.98 | J/mol×K | 1133.24 | Joback Calculated Property |
| Cp,gas | 1264.15 | J/mol×K | 1169.03 | Joback Calculated Property |
| η | [0.0000201; 0.0004901] | Pa×s | [509.77; 954.32] |
|
| η | 0.0004901 | Pa×s | 509.77 | Joback Calculated Property |
| η | 0.0002052 | Pa×s | 583.86 | Joback Calculated Property |
| η | 0.0001046 | Pa×s | 657.95 | Joback Calculated Property |
| η | 0.0000611 | Pa×s | 732.04 | Joback Calculated Property |
| η | 0.0000394 | Pa×s | 806.14 | Joback Calculated Property |
| η | 0.0000273 | Pa×s | 880.23 | Joback Calculated Property |
| η | 0.0000201 | Pa×s | 954.32 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Phthalic acid, decyl 2,4-dimethylpent-3-yl ester.
Sources
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