- InChI
- InChI=1S/C29H56O5/c1-3-4-5-6-7-8-9-10-11-12-13-16-19-22-25-33-28(30)23-20-17-14-15-18-21-24-29(31)34-27-26-32-2/h3-27H2,1-2H3
- InChI Key
- OKSNYVZZBKFZGI-UHFFFAOYSA-N
- Formula
- C29H56O5
- SMILES
-
CCCCCCCCCCCCCCCCOC(=O)CCCCCCCC
C(=O)OCCOC - Molecular Weight1
- 484.75
- 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 | 1.3981 | Relay (... Calculated Property | |
| ΔfG° | -379.54 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1354.36 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 77.63 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 137.92 | kJ/mol | Relay (... Calculated Property |
| IE | 9.74 | eV | Relay (... Calculated Property |
| log10WS | -7.37 | Relay (... Calculated Property | |
| logPoct/wat | 8.321 | Crippen Calculated Property | |
| McVol | 440.220 | ml/mol | McGowan Calculated Property |
| Pc | 648.45 | kPa | Joback Calculated Property |
| Inp | [3411.00; 3411.00] |
|
|
| Inp | 3411.00 | NIST | |
| Inp | 3411.00 | NIST | |
| Tboil | 684.61 | K | Relay (... Calculated Property |
| Tc | 851.99 | K | Relay (... Calculated Property |
| Tfus | 318.91 | K | Relay (... Calculated Property |
| Vc | 1.706 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1570.74; 1668.51] | J/mol×K | [1037.92; 1304.09] |
|
| Cp,gas | 1570.74 | J/mol×K | 1037.92 | Joback Calculated Property |
| Cp,gas | 1593.58 | J/mol×K | 1082.28 | Joback Calculated Property |
| Cp,gas | 1613.69 | J/mol×K | 1126.64 | Joback Calculated Property |
| Cp,gas | 1631.16 | J/mol×K | 1171.00 | Joback Calculated Property |
| Cp,gas | 1646.07 | J/mol×K | 1215.37 | Joback Calculated Property |
| Cp,gas | 1658.49 | J/mol×K | 1259.73 | Joback Calculated Property |
| Cp,gas | 1668.51 | J/mol×K | 1304.09 | Joback Calculated Property |
| η | [0.0000098; 0.0001838] | Pa×s | [583.14; 1037.92] |
|
| η | 0.0001838 | Pa×s | 583.14 | Joback Calculated Property |
| η | 0.0000851 | Pa×s | 658.94 | Joback Calculated Property |
| η | 0.0000462 | Pa×s | 734.73 | Joback Calculated Property |
| η | 0.0000281 | Pa×s | 810.53 | Joback Calculated Property |
| η | 0.0000187 | Pa×s | 886.33 | Joback Calculated Property |
| η | 0.0000132 | Pa×s | 962.12 | Joback Calculated Property |
| η | 0.0000098 | Pa×s | 1037.92 | Joback Calculated Property |
Similar Compounds
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Sources
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