- InChI
- InChI=1S/C20H38O4/c1-6-18(17(4)5)24-20(22)14-12-10-8-7-9-11-13-19(21)23-15-16(2)3/h16-18H,6-15H2,1-5H3
- InChI Key
- MZBIQQBVTBBFCC-UHFFFAOYSA-N
- Formula
- C20H38O4
- SMILES
-
CCC(OC(=O)CCCCCCCCC(=O)OCC(C)C
)C(C)C - Molecular Weight1
- 342.51
- 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° | -357.64 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -961.57 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 42.56 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 77.26 | kJ/mol | Joback Calculated Property |
| log10WS | -5.55 | Crippen Calculated Property | |
| logPoct/wat | 5.284 | Crippen Calculated Property | |
| McVol | 307.540 | ml/mol | McGowan Calculated Property |
| Pc | 1094.99 | kPa | Joback Calculated Property |
| Inp | [2233.00; 2233.00] |
|
|
| Inp | 2233.00 | NIST | |
| Inp | 2233.00 | NIST | |
| Tboil | 808.26 | K | Joback Calculated Property |
| Tc | 994.56 | K | Joback Calculated Property |
| Tfus | 414.48 | K | Joback Calculated Property |
| Vc | 1.185 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [970.62; 1065.59] | J/mol×K | [808.26; 994.56] |
|
| Cp,gas | 970.62 | J/mol×K | 808.26 | Joback Calculated Property |
| Cp,gas | 989.13 | J/mol×K | 839.31 | Joback Calculated Property |
| Cp,gas | 1006.54 | J/mol×K | 870.36 | Joback Calculated Property |
| Cp,gas | 1022.88 | J/mol×K | 901.41 | Joback Calculated Property |
| Cp,gas | 1038.15 | J/mol×K | 932.46 | Joback Calculated Property |
| Cp,gas | 1052.38 | J/mol×K | 963.51 | Joback Calculated Property |
| Cp,gas | 1065.59 | J/mol×K | 994.56 | Joback Calculated Property |
| η | [0.0000412; 0.0014761] | Pa×s | [414.48; 808.26] |
|
| η | 0.0014761 | Pa×s | 414.48 | Joback Calculated Property |
| η | 0.0005410 | Pa×s | 480.11 | Joback Calculated Property |
| η | 0.0002524 | Pa×s | 545.74 | Joback Calculated Property |
| η | 0.0001387 | Pa×s | 611.37 | Joback Calculated Property |
| η | 0.0000856 | Pa×s | 677.00 | Joback Calculated Property |
| η | 0.0000575 | Pa×s | 742.63 | Joback Calculated Property |
| η | 0.0000412 | Pa×s | 808.26 | Joback Calculated Property |
Similar Compounds
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Sources
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