- InChI
- InChI=1S/C30H42O4/c1-3-5-6-7-8-9-10-11-12-13-16-23-33-29(31)26-20-17-21-27(24-26)30(32)34-28-22-15-14-19-25(28)18-4-2/h14-15,17,19-22,24H,3-13,16,18,23H2,1-2H3
- InChI Key
- XAEZBVGHKBDCLK-UHFFFAOYSA-N
- Formula
- C30H42O4
- SMILES
-
CCCCCCCCCCCCCOC(=O)c1cccc(C(=O
)Oc2ccccc2CCC)c1 - Molecular Weight1
- 466.65
- 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° | -60.56 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -702.01 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 66.33 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 106.56 | kJ/mol | Joback Calculated Property |
| log10WS | -10.05 | Crippen Calculated Property | |
| logPoct/wat | 8.326 | Crippen Calculated Property | |
| McVol | 400.920 | ml/mol | McGowan Calculated Property |
| Pc | 878.44 | kPa | Joback Calculated Property |
| Inp | 3490.00 | NIST | |
| Tboil | 1101.70 | K | Joback Calculated Property |
| Tc | 1351.81 | K | Joback Calculated Property |
| Tfus | 650.06 | K | Joback Calculated Property |
| Vc | 1.548 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1383.47; 1447.21] | J/mol×K | [1101.70; 1351.81] | 
|
| Cp,gas | 1383.47 | J/mol×K | 1101.70 | Joback Calculated Property |
| Cp,gas | 1398.34 | J/mol×K | 1143.38 | Joback Calculated Property |
| Cp,gas | 1411.38 | J/mol×K | 1185.07 | Joback Calculated Property |
| Cp,gas | 1422.69 | J/mol×K | 1226.75 | Joback Calculated Property |
| Cp,gas | 1432.37 | J/mol×K | 1268.44 | Joback Calculated Property |
| Cp,gas | 1440.51 | J/mol×K | 1310.12 | Joback Calculated Property |
| Cp,gas | 1447.21 | J/mol×K | 1351.81 | Joback Calculated Property |
| η | [0.0000132; 0.0001479] | Pa×s | [650.06; 1101.70] |
|
| η | 0.0001479 | Pa×s | 650.06 | Joback Calculated Property |
| η | 0.0000801 | Pa×s | 725.33 | Joback Calculated Property |
| η | 0.0000487 | Pa×s | 800.61 | Joback Calculated Property |
| η | 0.0000323 | Pa×s | 875.88 | Joback Calculated Property |
| η | 0.0000228 | Pa×s | 951.15 | Joback Calculated Property |
| η | 0.0000170 | Pa×s | 1026.43 | Joback Calculated Property |
| η | 0.0000132 | Pa×s | 1101.70 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Isophthalic acid, 2-propylphenyl tridecyl ester.
Sources
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