- InChI
- InChI=1S/C23H34O5/c1-19(2)10-9-17-27-22(25)11-7-5-3-4-6-8-12-23(26)28-21-15-13-20(18-24)14-16-21/h13-16,18-19H,3-12,17H2,1-2H3
- InChI Key
- HARORJGQTQDJOB-UHFFFAOYSA-N
- Formula
- C23H34O5
- SMILES
-
CC(C)CCCOC(=O)CCCCCCCCC(=O)Oc1
ccc(C=O)cc1 - Molecular Weight1
- 390.51
- 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° | -324.24 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -873.45 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 53.32 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 94.37 | kJ/mol | Joback Calculated Property |
| log10WS | -6.51 | Crippen Calculated Property | |
| logPoct/wat | 5.505 | Crippen Calculated Property | |
| McVol | 327.620 | ml/mol | McGowan Calculated Property |
| Pc | 1160.08 | kPa | Joback Calculated Property |
| Inp | [3071.00; 3071.00] |
|
|
| Inp | 3071.00 | NIST | |
| Inp | 3071.00 | NIST | |
| Tboil | 958.10 | K | Joback Calculated Property |
| Tc | 1173.62 | K | Joback Calculated Property |
| Tfus | 559.23 | K | Joback Calculated Property |
| Vc | 1.274 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1073.42; 1143.18] | J/mol×K | [958.10; 1173.62] |
|
| Cp,gas | 1073.42 | J/mol×K | 958.10 | Joback Calculated Property |
| Cp,gas | 1088.36 | J/mol×K | 994.02 | Joback Calculated Property |
| Cp,gas | 1101.92 | J/mol×K | 1029.94 | Joback Calculated Property |
| Cp,gas | 1114.15 | J/mol×K | 1065.86 | Joback Calculated Property |
| Cp,gas | 1125.07 | J/mol×K | 1101.78 | Joback Calculated Property |
| Cp,gas | 1134.74 | J/mol×K | 1137.70 | Joback Calculated Property |
| Cp,gas | 1143.18 | J/mol×K | 1173.62 | Joback Calculated Property |
| η | [0.0000347; 0.0004445] | Pa×s | [559.23; 958.10] |
|
| η | 0.0004445 | Pa×s | 559.23 | Joback Calculated Property |
| η | 0.0002319 | Pa×s | 625.71 | Joback Calculated Property |
| η | 0.0001371 | Pa×s | 692.19 | Joback Calculated Property |
| η | 0.0000888 | Pa×s | 758.66 | Joback Calculated Property |
| η | 0.0000618 | Pa×s | 825.14 | Joback Calculated Property |
| η | 0.0000453 | Pa×s | 891.62 | Joback Calculated Property |
| η | 0.0000347 | Pa×s | 958.10 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Sebacic acid, 4-formylphenyl isohexyl ester.
Sources
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