- InChI
- InChI=1S/C29H56O4/c1-6-7-8-9-10-11-12-15-18-21-24-32-27(30)22-19-16-13-14-17-20-23-28(31)33-29(25(2)3)26(4)5/h25-26,29H,6-24H2,1-5H3
- InChI Key
- WOAFIVGPLYEYHA-UHFFFAOYSA-N
- Formula
- C29H56O4
- SMILES
-
CCCCCCCCCCCCOC(=O)CCCCCCCCC(=O
)OC(C(C)C)C(C)C - Molecular Weight1
- 468.75
- 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 | 1.2631 | Relay (1.0) Calculated Property | |
| ΔfG° | -281.86 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1257.58 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 65.87 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 122.85 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.61 | eV | Relay (1.0) Calculated Property |
| log10WS | -7.70 | Relay (1.0) Calculated Property | |
| logPoct/wat | 8.795 | Crippen Calculated Property | |
| McVol | 434.350 | ml/mol | McGowan Calculated Property |
| Pc | 662.21 | kPa | Joback Calculated Property |
| Inp | 3131.00 | NIST | |
| Tboil | 667.57 | K | Relay (1.0) Calculated Property |
| Tc | 842.82 | K | Relay (1.0) Calculated Property |
| Tfus | 288.81 | K | Relay (1.0) Calculated Property |
| Vc | 1.641 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1540.49; 1644.87] | J/mol×K | [1014.18; 1258.93] | 
|
| Cp,gas | 1540.49 | J/mol×K | 1014.18 | Joback Calculated Property |
| Cp,gas | 1563.07 | J/mol×K | 1054.97 | Joback Calculated Property |
| Cp,gas | 1583.46 | J/mol×K | 1095.76 | Joback Calculated Property |
| Cp,gas | 1601.76 | J/mol×K | 1136.55 | Joback Calculated Property |
| Cp,gas | 1618.04 | J/mol×K | 1177.34 | Joback Calculated Property |
| Cp,gas | 1632.38 | J/mol×K | 1218.13 | Joback Calculated Property |
| Cp,gas | 1644.87 | J/mol×K | 1258.93 | Joback Calculated Property |
| η | [0.0000101; 0.0004111] | Pa×s | [515.91; 1014.18] |
|
| η | 0.0004111 | Pa×s | 515.91 | Joback Calculated Property |
| η | 0.0001445 | Pa×s | 598.96 | Joback Calculated Property |
| η | 0.0000655 | Pa×s | 682.00 | Joback Calculated Property |
| η | 0.0000353 | Pa×s | 765.05 | Joback Calculated Property |
| η | 0.0000214 | Pa×s | 848.09 | Joback Calculated Property |
| η | 0.0000142 | Pa×s | 931.14 | Joback Calculated Property |
| η | 0.0000101 | Pa×s | 1014.18 | Joback Calculated Property |
Similar Compounds
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Sources
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