- InChI
- InChI=1S/C23H44O4/c1-5-6-7-8-9-10-11-12-13-14-15-19-26-21(24)17-16-18-22(25)27-20-23(2,3)4/h5-20H2,1-4H3
- InChI Key
- DOMOKANFIOSVHH-UHFFFAOYSA-N
- Formula
- C23H44O4
- SMILES
-
CCCCCCCCCCCCCOC(=O)CCCC(=O)OCC
(C)(C)C - Molecular Weight1
- 384.59
- 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° | -322.22 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1016.40 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 53.49 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 83.81 | kJ/mol | Joback Calculated Property |
| log10WS | -6.93 | Crippen Calculated Property | |
| logPoct/wat | 6.600 | Crippen Calculated Property | |
| McVol | 349.810 | ml/mol | McGowan Calculated Property |
| Pc | 909.98 | kPa | Joback Calculated Property |
| Inp | 2593.00 | NIST | |
| Tboil | 874.99 | K | Joback Calculated Property |
| Tc | 1071.31 | K | Joback Calculated Property |
| Tfus | 495.71 | K | Joback Calculated Property |
| Vc | 1.361 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1154.79; 1253.57] | J/mol×K | [874.99; 1071.31] | 
|
| Cp,gas | 1154.79 | J/mol×K | 874.99 | Joback Calculated Property |
| Cp,gas | 1174.20 | J/mol×K | 907.71 | Joback Calculated Property |
| Cp,gas | 1192.37 | J/mol×K | 940.43 | Joback Calculated Property |
| Cp,gas | 1209.35 | J/mol×K | 973.15 | Joback Calculated Property |
| Cp,gas | 1225.18 | J/mol×K | 1005.87 | Joback Calculated Property |
| Cp,gas | 1239.91 | J/mol×K | 1038.59 | Joback Calculated Property |
| Cp,gas | 1253.57 | J/mol×K | 1071.31 | Joback Calculated Property |
| η | [0.0000268; 0.0005484] | Pa×s | [495.71; 874.99] |
|
| η | 0.0005484 | Pa×s | 495.71 | Joback Calculated Property |
| η | 0.0002494 | Pa×s | 558.92 | Joback Calculated Property |
| η | 0.0001331 | Pa×s | 622.14 | Joback Calculated Property |
| η | 0.0000798 | Pa×s | 685.35 | Joback Calculated Property |
| η | 0.0000521 | Pa×s | 748.56 | Joback Calculated Property |
| η | 0.0000364 | Pa×s | 811.78 | Joback Calculated Property |
| η | 0.0000268 | Pa×s | 874.99 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, neopentyl tridecyl ester.
Sources
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