- InChI
- InChI=1S/C23H44O4/c1-6-7-8-9-10-11-12-13-14-15-19-26-21(24)17-16-18-22(25)27-20(2)23(3,4)5/h20H,6-19H2,1-5H3
- InChI Key
- PGZPKCXIWRERFX-UHFFFAOYSA-N
- Formula
- C23H44O4
- SMILES
-
CCCCCCCCCCCCOC(=O)CCCC(=O)OC(C
)C(C)(C)C - Molecular Weight1
- 384.59
- 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 | 1.0453 | Relay (1.0) Calculated Property | |
| ΔfG° | -324.66 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1155.89 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 49.96 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 101.39 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.60 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.08 | Relay (1.0) Calculated Property | |
| logPoct/wat | 6.599 | Crippen Calculated Property | |
| McVol | 349.810 | ml/mol | McGowan Calculated Property |
| Pc | 914.39 | kPa | Joback Calculated Property |
| Inp | 2574.00 | NIST | |
| Tboil | 625.60 | K | Relay (1.0) Calculated Property |
| Tc | 802.33 | K | Relay (1.0) Calculated Property |
| Tfus | 296.86 | K | Relay (1.0) Calculated Property |
| Vc | 1.326 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1155.24; 1253.82] | J/mol×K | [874.55; 1070.98] | 
|
| Cp,gas | 1155.24 | J/mol×K | 874.55 | Joback Calculated Property |
| Cp,gas | 1174.64 | J/mol×K | 907.29 | Joback Calculated Property |
| Cp,gas | 1192.79 | J/mol×K | 940.03 | Joback Calculated Property |
| Cp,gas | 1209.75 | J/mol×K | 972.76 | Joback Calculated Property |
| Cp,gas | 1225.54 | J/mol×K | 1005.50 | Joback Calculated Property |
| Cp,gas | 1240.21 | J/mol×K | 1038.24 | Joback Calculated Property |
| Cp,gas | 1253.82 | J/mol×K | 1070.98 | Joback Calculated Property |
| η | [0.0000245; 0.0006448] | Pa×s | [480.71; 874.55] |
|
| η | 0.0006448 | Pa×s | 480.71 | Joback Calculated Property |
| η | 0.0002695 | Pa×s | 546.35 | Joback Calculated Property |
| η | 0.0001358 | Pa×s | 611.99 | Joback Calculated Property |
| η | 0.0000781 | Pa×s | 677.63 | Joback Calculated Property |
| η | 0.0000496 | Pa×s | 743.27 | Joback Calculated Property |
| η | 0.0000339 | Pa×s | 808.91 | Joback Calculated Property |
| η | 0.0000245 | Pa×s | 874.55 | Joback Calculated Property |
Similar Compounds
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Sources
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