- InChI
- InChI=1S/C22H40O5/c1-2-3-4-5-6-7-8-9-10-11-17-26-21(23)15-12-16-22(24)27-19-20-14-13-18-25-20/h20H,2-19H2,1H3
- InChI Key
- WILVXCOCWZMSSZ-UHFFFAOYSA-N
- Formula
- C22H40O5
- SMILES
-
CCCCCCCCCCCCOC(=O)CCCC(=O)OCC1
CCCO1 - Molecular Weight1
- 384.55
- 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° | -383.05 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1058.53 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 60.22 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 87.64 | kJ/mol | Joback Calculated Property |
| log10WS | -5.85 | Crippen Calculated Property | |
| logPoct/wat | 5.343 | Crippen Calculated Property | |
| McVol | 330.730 | ml/mol | McGowan Calculated Property |
| Pc | 1063.10 | kPa | Joback Calculated Property |
| Inp | 2835.00 | NIST | |
| Tboil | 897.57 | K | Joback Calculated Property |
| Tc | 1099.61 | K | Joback Calculated Property |
| Tfus | 519.49 | K | Joback Calculated Property |
| Vc | 1.278 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1120.29; 1211.25] | J/mol×K | [897.57; 1099.61] | 
|
| Cp,gas | 1120.29 | J/mol×K | 897.57 | Joback Calculated Property |
| Cp,gas | 1138.72 | J/mol×K | 931.24 | Joback Calculated Property |
| Cp,gas | 1155.80 | J/mol×K | 964.92 | Joback Calculated Property |
| Cp,gas | 1171.55 | J/mol×K | 998.59 | Joback Calculated Property |
| Cp,gas | 1186.02 | J/mol×K | 1032.26 | Joback Calculated Property |
| Cp,gas | 1199.25 | J/mol×K | 1065.94 | Joback Calculated Property |
| Cp,gas | 1211.25 | J/mol×K | 1099.61 | Joback Calculated Property |
| η | [0.0000505; 0.0007076] | Pa×s | [519.49; 897.57] |
|
| η | 0.0007076 | Pa×s | 519.49 | Joback Calculated Property |
| η | 0.0003592 | Pa×s | 582.50 | Joback Calculated Property |
| η | 0.0002081 | Pa×s | 645.52 | Joback Calculated Property |
| η | 0.0001329 | Pa×s | 708.53 | Joback Calculated Property |
| η | 0.0000913 | Pa×s | 771.54 | Joback Calculated Property |
| η | 0.0000664 | Pa×s | 834.56 | Joback Calculated Property |
| η | 0.0000505 | Pa×s | 897.57 | Joback Calculated Property |
Similar Compounds
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Sources
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