- InChI
- InChI=1S/C28H46O5/c1-3-4-5-6-7-8-9-10-11-12-13-14-17-23-32-27(29)21-18-22-28(30)33-24-25-19-15-16-20-26(25)31-2/h15-16,19-20H,3-14,17-18,21-24H2,1-2H3
- InChI Key
- PZNVKUXHQVAKQD-UHFFFAOYSA-N
- Formula
- C28H46O5
- SMILES
-
CCCCCCCCCCCCCCCOC(=O)CCCC(=O)O
Cc1ccccc1OC - Molecular Weight1
- 462.66
- 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° | -285.18 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1018.01 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 68.69 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 101.58 | kJ/mol | Joback Calculated Property |
| log10WS | -8.57 | Crippen Calculated Property | |
| logPoct/wat | 7.543 | Crippen Calculated Property | |
| McVol | 402.370 | ml/mol | McGowan Calculated Property |
| Pc | 809.37 | kPa | Joback Calculated Property |
| Inp | 3435.00 | NIST | |
| Tboil | 1046.70 | K | Joback Calculated Property |
| Tc | 1290.03 | K | Joback Calculated Property |
| Tfus | 610.81 | K | Joback Calculated Property |
| Vc | 1.562 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1398.39; 1471.71] | J/mol×K | [1046.70; 1290.03] | 
|
| Cp,gas | 1398.39 | J/mol×K | 1046.70 | Joback Calculated Property |
| Cp,gas | 1415.66 | J/mol×K | 1087.26 | Joback Calculated Property |
| Cp,gas | 1430.83 | J/mol×K | 1127.81 | Joback Calculated Property |
| Cp,gas | 1443.96 | J/mol×K | 1168.37 | Joback Calculated Property |
| Cp,gas | 1455.12 | J/mol×K | 1208.92 | Joback Calculated Property |
| Cp,gas | 1464.35 | J/mol×K | 1249.48 | Joback Calculated Property |
| Cp,gas | 1471.71 | J/mol×K | 1290.03 | Joback Calculated Property |
| η | [0.0000123; 0.0001623] | Pa×s | [610.81; 1046.70] |
|
| η | 0.0001623 | Pa×s | 610.81 | Joback Calculated Property |
| η | 0.0000840 | Pa×s | 683.46 | Joback Calculated Property |
| η | 0.0000493 | Pa×s | 756.11 | Joback Calculated Property |
| η | 0.0000318 | Pa×s | 828.75 | Joback Calculated Property |
| η | 0.0000220 | Pa×s | 901.40 | Joback Calculated Property |
| η | 0.0000161 | Pa×s | 974.05 | Joback Calculated Property |
| η | 0.0000123 | Pa×s | 1046.70 | Joback Calculated Property |
Similar Compounds
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Sources
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