- InChI
- InChI=1S/C23H34O5/c1-3-4-13-18-27-22(25)16-9-7-5-6-8-10-17-23(26)28-21-15-12-11-14-20(21)19(2)24/h11-12,14-15H,3-10,13,16-18H2,1-2H3
- InChI Key
- YAQYTJHYPMUSSF-UHFFFAOYSA-N
- Formula
- C23H34O5
- SMILES
-
CCCCCOC(=O)CCCCCCCCC(=O)Oc1ccc
cc1C(C)=O - 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° | -351.20 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -895.17 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 56.15 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 94.79 | kJ/mol | Joback Calculated Property |
| log10WS | -6.75 | Crippen Calculated Property | |
| logPoct/wat | 5.649 | Crippen Calculated Property | |
| McVol | 327.620 | ml/mol | McGowan Calculated Property |
| Pc | 1145.21 | kPa | Joback Calculated Property |
| Inp | [2920.00; 2920.00] |
|
|
| Inp | 2920.00 | NIST | |
| Inp | 2920.00 | NIST | |
| Tboil | 963.75 | K | Joback Calculated Property |
| Tc | 1180.39 | K | Joback Calculated Property |
| Tfus | 582.16 | K | Joback Calculated Property |
| Vc | 1.270 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1073.48; 1142.53] | J/mol×K | [963.75; 1180.39] |
|
| Cp,gas | 1073.48 | J/mol×K | 963.75 | Joback Calculated Property |
| Cp,gas | 1088.36 | J/mol×K | 999.86 | Joback Calculated Property |
| Cp,gas | 1101.83 | J/mol×K | 1035.96 | Joback Calculated Property |
| Cp,gas | 1113.95 | J/mol×K | 1072.07 | Joback Calculated Property |
| Cp,gas | 1124.75 | J/mol×K | 1108.18 | Joback Calculated Property |
| Cp,gas | 1134.27 | J/mol×K | 1144.29 | Joback Calculated Property |
| Cp,gas | 1142.53 | J/mol×K | 1180.39 | Joback Calculated Property |
| η | [0.0000338; 0.0003506] | Pa×s | [582.16; 963.75] |
|
| η | 0.0003506 | Pa×s | 582.16 | Joback Calculated Property |
| η | 0.0001959 | Pa×s | 645.76 | Joback Calculated Property |
| η | 0.0001215 | Pa×s | 709.36 | Joback Calculated Property |
| η | 0.0000815 | Pa×s | 772.95 | Joback Calculated Property |
| η | 0.0000581 | Pa×s | 836.55 | Joback Calculated Property |
| η | 0.0000435 | Pa×s | 900.15 | Joback Calculated Property |
| η | 0.0000338 | Pa×s | 963.75 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Sebacic acid, 2-acetylphenyl pentyl ester.
Sources
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