- InChI
- InChI=1S/C29H54O4/c1-3-5-7-8-9-10-11-12-13-14-17-20-23-27-33-29(31)25-22-19-16-15-18-21-24-28(30)32-26-6-4-2/h4H,2-3,5-27H2,1H3
- InChI Key
- QWUVIJUUGFNXQQ-UHFFFAOYSA-N
- Formula
- C29H54O4
- SMILES
-
C=CCCOC(=O)CCCCCCCCC(=O)OCCCCC
CCCCCCCCCC - Molecular Weight1
- 466.74
- 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° | -186.70 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1006.06 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 75.16 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 97.79 | kJ/mol | Joback Calculated Property |
| log10WS | -9.54 | Crippen Calculated Property | |
| logPoct/wat | 8.861 | Crippen Calculated Property | |
| McVol | 430.050 | ml/mol | McGowan Calculated Property |
| Pc | 668.39 | kPa | Joback Calculated Property |
| Inp | 3266.00 | NIST | |
| Tboil | 1012.18 | K | Joback Calculated Property |
| Tc | 1261.06 | K | Joback Calculated Property |
| Tfus | 559.15 | K | Joback Calculated Property |
| Vc | 1.688 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1509.12; 1616.64] | J/mol×K | [1012.18; 1261.06] | 
|
| Cp,gas | 1509.12 | J/mol×K | 1012.18 | Joback Calculated Property |
| Cp,gas | 1531.97 | J/mol×K | 1053.66 | Joback Calculated Property |
| Cp,gas | 1552.72 | J/mol×K | 1095.14 | Joback Calculated Property |
| Cp,gas | 1571.47 | J/mol×K | 1136.62 | Joback Calculated Property |
| Cp,gas | 1588.31 | J/mol×K | 1178.10 | Joback Calculated Property |
| Cp,gas | 1603.33 | J/mol×K | 1219.58 | Joback Calculated Property |
| Cp,gas | 1616.64 | J/mol×K | 1261.06 | Joback Calculated Property |
| η | [0.0000146; 0.0002845] | Pa×s | [559.15; 1012.18] |
|
| η | 0.0002845 | Pa×s | 559.15 | Joback Calculated Property |
| η | 0.0001291 | Pa×s | 634.66 | Joback Calculated Property |
| η | 0.0000693 | Pa×s | 710.16 | Joback Calculated Property |
| η | 0.0000420 | Pa×s | 785.67 | Joback Calculated Property |
| η | 0.0000277 | Pa×s | 861.17 | Joback Calculated Property |
| η | 0.0000196 | Pa×s | 936.68 | Joback Calculated Property |
| η | 0.0000146 | Pa×s | 1012.18 | Joback Calculated Property |
Similar Compounds
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Sources
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