- InChI
- InChI=1S/C26H50O4/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23-29-25(27)21-20-22-26(28)30-24(2)3/h24H,4-23H2,1-3H3
- InChI Key
- WGFSXLMEUSPSIF-UHFFFAOYSA-N
- Formula
- C26H50O4
- SMILES
-
CCCCCCCCCCCCCCCCCCOC(=O)CCCC(=
O)OC(C)C - Molecular Weight1
- 426.67
- ω : Acentric Factor.
- 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).
- 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 | 1.2196 | Relay (1.0) Calculated Property | |
| ΔfG° | -302.24 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1202.72 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 65.15 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 120.83 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.71 | eV | Relay (1.0) Calculated Property |
| log10WS | -7.18 | Relay (1.0) Calculated Property | |
| logPoct/wat | 7.913 | Crippen Calculated Property | |
| McVol | 392.080 | ml/mol | McGowan Calculated Property |
| Pc | 765.64 | kPa | Joback Calculated Property |
| Inp | [2959.00; 2959.00] |
|
|
| Inp | 2959.00 | NIST | |
| Inp | 2959.00 | NIST | |
| Tboil | 642.60 | K | Relay (1.0) Calculated Property |
| Tc | 819.07 | K | Relay (1.0) Calculated Property |
| Tfus | 306.34 | K | Relay (1.0) Calculated Property |
| Vc | 1.530 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1345.59; 1448.73] | J/mol×K | [946.42; 1164.49] |
|
| Cp,gas | 1345.59 | J/mol×K | 946.42 | Joback Calculated Property |
| Cp,gas | 1366.80 | J/mol×K | 982.76 | Joback Calculated Property |
| Cp,gas | 1386.34 | J/mol×K | 1019.11 | Joback Calculated Property |
| Cp,gas | 1404.25 | J/mol×K | 1055.45 | Joback Calculated Property |
| Cp,gas | 1420.58 | J/mol×K | 1091.80 | Joback Calculated Property |
| Cp,gas | 1435.40 | J/mol×K | 1128.14 | Joback Calculated Property |
| Cp,gas | 1448.73 | J/mol×K | 1164.49 | Joback Calculated Property |
| η | [0.0000197; 0.0004671] | Pa×s | [512.10; 946.42] |
|
| η | 0.0004671 | Pa×s | 512.10 | Joback Calculated Property |
| η | 0.0001988 | Pa×s | 584.49 | Joback Calculated Property |
| η | 0.0001021 | Pa×s | 656.87 | Joback Calculated Property |
| η | 0.0000599 | Pa×s | 729.26 | Joback Calculated Property |
| η | 0.0000387 | Pa×s | 801.65 | Joback Calculated Property |
| η | 0.0000268 | Pa×s | 874.03 | Joback Calculated Property |
| η | 0.0000197 | Pa×s | 946.42 | Joback Calculated Property |
Similar Compounds
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Sources
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