- InChI
- InChI=1S/C27H36O4/c1-3-5-6-7-8-9-10-15-21-30-26(28)23-18-12-13-19-24(23)27(29)31-25-20-14-11-17-22(25)16-4-2/h11-14,17-20H,3-10,15-16,21H2,1-2H3
- InChI Key
- RXKUUEJNPQUJGH-UHFFFAOYSA-N
- Formula
- C27H36O4
- SMILES
-
CCCCCCCCCCOC(=O)c1ccccc1C(=O)O
c1ccccc1CCC - Molecular Weight1
- 424.57
- 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° | -85.82 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -640.09 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 58.56 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 99.88 | kJ/mol | Joback Calculated Property |
| log10WS | -8.79 | Crippen Calculated Property | |
| logPoct/wat | 7.156 | Crippen Calculated Property | |
| McVol | 358.650 | ml/mol | McGowan Calculated Property |
| Pc | 1050.05 | kPa | Joback Calculated Property |
| Inp | [3032.00; 3032.00] |
|
|
| Inp | 3032.00 | NIST | |
| Inp | 3032.00 | NIST | |
| Tboil | 1033.06 | K | Joback Calculated Property |
| Tc | 1265.06 | K | Joback Calculated Property |
| Tfus | 616.25 | K | Joback Calculated Property |
| Vc | 1.379 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1197.89; 1262.73] | J/mol×K | [1033.06; 1265.06] |
|
| Cp,gas | 1197.89 | J/mol×K | 1033.06 | Joback Calculated Property |
| Cp,gas | 1212.40 | J/mol×K | 1071.73 | Joback Calculated Property |
| Cp,gas | 1225.34 | J/mol×K | 1110.39 | Joback Calculated Property |
| Cp,gas | 1236.78 | J/mol×K | 1149.06 | Joback Calculated Property |
| Cp,gas | 1246.78 | J/mol×K | 1187.73 | Joback Calculated Property |
| Cp,gas | 1255.41 | J/mol×K | 1226.39 | Joback Calculated Property |
| Cp,gas | 1262.73 | J/mol×K | 1265.06 | Joback Calculated Property |
| η | [0.0000209; 0.0002136] | Pa×s | [616.25; 1033.06] |
|
| η | 0.0002136 | Pa×s | 616.25 | Joback Calculated Property |
| η | 0.0001191 | Pa×s | 685.72 | Joback Calculated Property |
| η | 0.0000739 | Pa×s | 755.19 | Joback Calculated Property |
| η | 0.0000497 | Pa×s | 824.65 | Joback Calculated Property |
| η | 0.0000356 | Pa×s | 894.12 | Joback Calculated Property |
| η | 0.0000267 | Pa×s | 963.59 | Joback Calculated Property |
| η | 0.0000209 | Pa×s | 1033.06 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Phthalic acid, decyl 2-propylphenyl ester.
Sources
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