- InChI
- InChI=1S/C29H56O4/c1-3-5-7-9-10-11-12-13-16-19-23-27-33-29(31)25-21-18-15-14-17-20-24-28(30)32-26-22-8-6-4-2/h3-27H2,1-2H3
- InChI Key
- GPRSKNYOJNFRIW-UHFFFAOYSA-N
- Formula
- C29H56O4
- SMILES
-
CCCCCCCCCCCCCOC(=O)CCCCCCCCC(=
O)OCCCCCC - 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 | 1.3668 | Relay (1.0) Calculated Property | |
| ΔfG° | -274.54 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1247.30 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 76.44 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 133.27 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.70 | eV | Relay (1.0) Calculated Property |
| log10WS | -8.09 | Relay (1.0) Calculated Property | |
| logPoct/wat | 9.085 | Crippen Calculated Property | |
| McVol | 434.350 | ml/mol | McGowan Calculated Property |
| Pc | 654.10 | kPa | Joback Calculated Property |
| Inp | [3333.00; 3333.00] |
|
|
| Inp | 3333.00 | NIST | |
| Inp | 3333.00 | NIST | |
| Tboil | 669.85 | K | Relay (1.0) Calculated Property |
| Tc | 843.68 | K | Relay (1.0) Calculated Property |
| Tfus | 312.53 | K | Relay (1.0) Calculated Property |
| Vc | 1.700 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1539.74; 1648.61] | J/mol×K | [1015.50; 1268.62] |
|
| Cp,gas | 1539.74 | J/mol×K | 1015.50 | Joback Calculated Property |
| Cp,gas | 1563.27 | J/mol×K | 1057.69 | Joback Calculated Property |
| Cp,gas | 1584.52 | J/mol×K | 1099.87 | Joback Calculated Property |
| Cp,gas | 1603.59 | J/mol×K | 1142.06 | Joback Calculated Property |
| Cp,gas | 1620.57 | J/mol×K | 1184.25 | Joback Calculated Property |
| Cp,gas | 1635.54 | J/mol×K | 1226.44 | Joback Calculated Property |
| Cp,gas | 1648.61 | J/mol×K | 1268.62 | Joback Calculated Property |
| η | [0.0000134; 0.0002741] | Pa×s | [560.91; 1015.50] |
|
| η | 0.0002741 | Pa×s | 560.91 | Joback Calculated Property |
| η | 0.0001230 | Pa×s | 636.67 | Joback Calculated Property |
| η | 0.0000654 | Pa×s | 712.44 | Joback Calculated Property |
| η | 0.0000393 | Pa×s | 788.20 | Joback Calculated Property |
| η | 0.0000258 | Pa×s | 863.97 | Joback Calculated Property |
| η | 0.0000181 | Pa×s | 939.73 | Joback Calculated Property |
| η | 0.0000134 | Pa×s | 1015.50 | Joback Calculated Property |
Similar Compounds
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Sources
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