- InChI
- InChI=1S/C25H38O4/c1-2-3-4-14-21-28-24(26)19-12-7-5-6-8-13-20-25(27)29-22-15-18-23-16-10-9-11-17-23/h9-11,15-18H,2-8,12-14,19-22H2,1H3/b18-15+
- InChI Key
- UUVQWXDKHIMDEH-OBGWFSINSA-N
- Formula
- C25H38O4
- SMILES
-
CCCCCCOC(=O)CCCCCCCCC(=O)OCC=C
c1ccccc1 - Molecular Weight1
- 402.57
- 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° | -115.59 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -695.18 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 60.32 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 91.79 | kJ/mol | Joback Calculated Property |
| log10WS | -7.14 | Crippen Calculated Property | |
| logPoct/wat | 6.487 | Crippen Calculated Property | |
| McVol | 349.930 | ml/mol | McGowan Calculated Property |
| Pc | 1012.30 | kPa | Joback Calculated Property |
| Inp | [3110.00; 3110.00] |
|
|
| Inp | 3110.00 | NIST | |
| Inp | 3110.00 | NIST | |
| Tboil | 954.82 | K | Joback Calculated Property |
| Tc | 1169.21 | K | Joback Calculated Property |
| Tfus | 537.17 | K | Joback Calculated Property |
| Vc | 1.355 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1153.74; 1237.81] | J/mol×K | [954.82; 1169.21] |
|
| Cp,gas | 1153.74 | J/mol×K | 954.82 | Joback Calculated Property |
| Cp,gas | 1170.75 | J/mol×K | 990.55 | Joback Calculated Property |
| Cp,gas | 1186.48 | J/mol×K | 1026.28 | Joback Calculated Property |
| Cp,gas | 1200.99 | J/mol×K | 1062.02 | Joback Calculated Property |
| Cp,gas | 1214.34 | J/mol×K | 1097.75 | Joback Calculated Property |
| Cp,gas | 1226.59 | J/mol×K | 1133.48 | Joback Calculated Property |
| Cp,gas | 1237.81 | J/mol×K | 1169.21 | Joback Calculated Property |
| η | [0.0000227; 0.0003657] | Pa×s | [537.17; 954.82] |
|
| η | 0.0003657 | Pa×s | 537.17 | Joback Calculated Property |
| η | 0.0001765 | Pa×s | 606.78 | Joback Calculated Property |
| η | 0.0000990 | Pa×s | 676.39 | Joback Calculated Property |
| η | 0.0000618 | Pa×s | 745.99 | Joback Calculated Property |
| η | 0.0000419 | Pa×s | 815.60 | Joback Calculated Property |
| η | 0.0000301 | Pa×s | 885.21 | Joback Calculated Property |
| η | 0.0000227 | Pa×s | 954.82 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Sebacic acid, hexyl 3-phenylallyl ester.
Sources
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