- InChI
- InChI=1S/C25H40O5/c1-20(2)12-11-19-28-24(26)13-9-7-5-6-8-10-14-25(27)30-23-17-15-22(16-18-23)29-21(3)4/h15-18,20-21H,5-14,19H2,1-4H3
- InChI Key
- DWAMIJYOOCLZRG-UHFFFAOYSA-N
- Formula
- C25H40O5
- SMILES
-
CC(C)CCCOC(=O)CCCCCCCCC(=O)Oc1
ccc(OC(C)C)cc1 - Molecular Weight1
- 420.58
- 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° | -315.32 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -966.65 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 53.87 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 94.13 | kJ/mol | Joback Calculated Property |
| log10WS | -7.34 | Crippen Calculated Property | |
| logPoct/wat | 6.479 | Crippen Calculated Property | |
| McVol | 360.100 | ml/mol | McGowan Calculated Property |
| Pc | 969.88 | kPa | Joback Calculated Property |
| Inp | 2971.00 | NIST | |
| Tboil | 977.18 | K | Joback Calculated Property |
| Tc | 1196.35 | K | Joback Calculated Property |
| Tfus | 547.00 | K | Joback Calculated Property |
| Vc | 1.381 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1211.69; 1286.02] | J/mol×K | [977.18; 1196.35] | 
|
| Cp,gas | 1211.69 | J/mol×K | 977.18 | Joback Calculated Property |
| Cp,gas | 1228.12 | J/mol×K | 1013.71 | Joback Calculated Property |
| Cp,gas | 1242.90 | J/mol×K | 1050.24 | Joback Calculated Property |
| Cp,gas | 1256.05 | J/mol×K | 1086.77 | Joback Calculated Property |
| Cp,gas | 1267.60 | J/mol×K | 1123.29 | Joback Calculated Property |
| Cp,gas | 1277.58 | J/mol×K | 1159.82 | Joback Calculated Property |
| Cp,gas | 1286.02 | J/mol×K | 1196.35 | Joback Calculated Property |
| η | [0.0000162; 0.0002896] | Pa×s | [547.00; 977.18] |
|
| η | 0.0002896 | Pa×s | 547.00 | Joback Calculated Property |
| η | 0.0001356 | Pa×s | 618.70 | Joback Calculated Property |
| η | 0.0000744 | Pa×s | 690.39 | Joback Calculated Property |
| η | 0.0000456 | Pa×s | 762.09 | Joback Calculated Property |
| η | 0.0000305 | Pa×s | 833.79 | Joback Calculated Property |
| η | 0.0000217 | Pa×s | 905.48 | Joback Calculated Property |
| η | 0.0000162 | Pa×s | 977.18 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Sebacic acid, isohexyl 4-isopropoxyphenyl ester.
Sources
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