- InChI
- InChI=1S/C29H56O4/c1-3-5-6-7-8-9-10-11-12-13-14-15-18-21-24-27-33-29(31)26-23-20-17-16-19-22-25-28(30)32-4-2/h3-27H2,1-2H3
- InChI Key
- FHHYYLFJQZPUPL-UHFFFAOYSA-N
- Formula
- C29H56O4
- SMILES
-
CCCCCCCCCCCCCCCCCOC(=O)CCCCCCC
CC(=O)OCC - 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 | 1.3534 | Relay (1.0) Calculated Property | |
| ΔfG° | -427.44 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1252.62 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 79.60 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 138.81 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.73 | eV | Relay (1.0) Calculated Property |
| log10WS | -8.26 | Relay (1.0) Calculated Property | |
| logPoct/wat | 9.085 | Crippen Calculated Property | |
| McVol | 434.350 | ml/mol | McGowan Calculated Property |
| Pc | 627.51 | kPa | Joback Calculated Property |
| Inp | 3296.00 | NIST | |
| Tboil | 668.33 | K | Relay (1.0) Calculated Property |
| Tc | 844.97 | K | Relay (1.0) Calculated Property |
| Tfus | 313.93 | K | Relay (1.0) Calculated Property |
| Vc | 1.702 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1519.55; 1626.92] | J/mol×K | [979.56; 1218.78] | 
|
| Cp,gas | 1519.55 | J/mol×K | 979.56 | Joback Calculated Property |
| Cp,gas | 1542.67 | J/mol×K | 1019.43 | Joback Calculated Property |
| Cp,gas | 1563.59 | J/mol×K | 1059.30 | Joback Calculated Property |
| Cp,gas | 1582.40 | J/mol×K | 1099.17 | Joback Calculated Property |
| Cp,gas | 1599.16 | J/mol×K | 1139.04 | Joback Calculated Property |
| Cp,gas | 1613.98 | J/mol×K | 1178.91 | Joback Calculated Property |
| Cp,gas | 1626.92 | J/mol×K | 1218.78 | Joback Calculated Property |
| η | [0.0000102; 0.0004201] | Pa×s | [501.25; 979.56] |
|
| η | 0.0004201 | Pa×s | 501.25 | Joback Calculated Property |
| η | 0.0001476 | Pa×s | 580.97 | Joback Calculated Property |
| η | 0.0000668 | Pa×s | 660.69 | Joback Calculated Property |
| η | 0.0000358 | Pa×s | 740.40 | Joback Calculated Property |
| η | 0.0000217 | Pa×s | 820.12 | Joback Calculated Property |
| η | 0.0000144 | Pa×s | 899.84 | Joback Calculated Property |
| η | 0.0000102 | Pa×s | 979.56 | Joback Calculated Property |
Similar Compounds
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Sources
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