- InChI
- InChI=1S/C28H52O5/c1-2-3-4-5-6-7-8-9-12-15-18-23-32-27(29)21-16-13-10-11-14-17-22-28(30)33-25-26-20-19-24-31-26/h26H,2-25H2,1H3
- InChI Key
- CSDZPVKESHUTPY-UHFFFAOYSA-N
- Formula
- C28H52O5
- SMILES
-
CCCCCCCCCCCCCOC(=O)CCCCCCCCC(=
O)OCC1CCCO1 - Molecular Weight1
- 468.71
- 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 | 1.2874 | Relay (1.0) Calculated Property | |
| ΔfG° | -332.53 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1293.83 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 75.76 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 136.17 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.65 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.44 | Relay (1.0) Calculated Property | |
| logPoct/wat | 7.684 | Crippen Calculated Property | |
| McVol | 415.270 | ml/mol | McGowan Calculated Property |
| Pc | 753.50 | kPa | Joback Calculated Property |
| Inp | 3421.00 | NIST | |
| Tboil | 698.17 | K | Relay (1.0) Calculated Property |
| Tc | 879.08 | K | Relay (1.0) Calculated Property |
| Tfus | 306.11 | K | Relay (1.0) Calculated Property |
| Vc | 1.604 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1501.08; 1595.40] | J/mol×K | [1034.85; 1279.66] | 
|
| Cp,gas | 1501.08 | J/mol×K | 1034.85 | Joback Calculated Property |
| Cp,gas | 1521.71 | J/mol×K | 1075.65 | Joback Calculated Property |
| Cp,gas | 1540.26 | J/mol×K | 1116.45 | Joback Calculated Property |
| Cp,gas | 1556.81 | J/mol×K | 1157.26 | Joback Calculated Property |
| Cp,gas | 1571.45 | J/mol×K | 1198.06 | Joback Calculated Property |
| Cp,gas | 1584.28 | J/mol×K | 1238.86 | Joback Calculated Property |
| Cp,gas | 1595.40 | J/mol×K | 1279.66 | Joback Calculated Property |
| η | [0.0000199; 0.0003323] | Pa×s | [587.11; 1034.85] |
|
| η | 0.0003323 | Pa×s | 587.11 | Joback Calculated Property |
| η | 0.0001595 | Pa×s | 661.73 | Joback Calculated Property |
| η | 0.0000888 | Pa×s | 736.36 | Joback Calculated Property |
| η | 0.0000551 | Pa×s | 810.98 | Joback Calculated Property |
| η | 0.0000371 | Pa×s | 885.60 | Joback Calculated Property |
| η | 0.0000265 | Pa×s | 960.23 | Joback Calculated Property |
| η | 0.0000199 | Pa×s | 1034.85 | Joback Calculated Property |
Similar Compounds
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Sources
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