- InChI
- InChI=1S/C24H44O4/c1-4-5-6-7-10-13-16-20-27-23(25)17-14-11-8-9-12-15-18-24(26)28-21-19-22(2)3/h19H,4-18,20-21H2,1-3H3
- InChI Key
- YYKBBJWZNHUKIB-UHFFFAOYSA-N
- Formula
- C24H44O4
- SMILES
-
CCCCCCCCCOC(=O)CCCCCCCCC(=O)OC
C=C(C)C - Molecular Weight1
- 396.60
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- 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).
- IE : Ionization energy (eV).
- 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 |
|---|---|---|---|
| ω | 1.1010 | Relay (... Calculated Property | |
| ΔfG° | -244.97 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1062.60 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 62.38 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 111.88 | kJ/mol | Relay (... Calculated Property |
| IE | 8.67 | eV | Relay (... Calculated Property |
| log10WS | -6.47 | Relay (... Calculated Property | |
| logPoct/wat | 6.910 | Crippen Calculated Property | |
| McVol | 359.600 | ml/mol | McGowan Calculated Property |
| Pc | 878.96 | kPa | Joback Calculated Property |
| Inp | 2787.00 | NIST | |
| Tboil | 642.16 | K | Relay (... Calculated Property |
| Tc | 814.84 | K | Relay (... Calculated Property |
| Tfus | 290.99 | K | Relay (... Calculated Property |
| Vc | 1.369 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1190.16; 1289.20] | J/mol×K | [905.14; 1108.46] | 
|
| Cp,gas | 1190.16 | J/mol×K | 905.14 | Joback Calculated Property |
| Cp,gas | 1209.71 | J/mol×K | 939.03 | Joback Calculated Property |
| Cp,gas | 1227.98 | J/mol×K | 972.91 | Joback Calculated Property |
| Cp,gas | 1245.02 | J/mol×K | 1006.80 | Joback Calculated Property |
| Cp,gas | 1260.87 | J/mol×K | 1040.69 | Joback Calculated Property |
| Cp,gas | 1275.58 | J/mol×K | 1074.58 | Joback Calculated Property |
| Cp,gas | 1289.20 | J/mol×K | 1108.46 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Sebacic acid, 3-methylbut-2-enyl nonyl ester.
Sources
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