- InChI
- InChI=1S/C27H43ClO4/c1-4-7-8-9-10-11-12-13-14-15-16-20-31-25(29)27(5-2,6-3)26(30)32-22-23-18-17-19-24(28)21-23/h17-19,21H,4-16,20,22H2,1-3H3
- InChI Key
- UTWWYFOJWRRVJZ-UHFFFAOYSA-N
- Formula
- C27H43ClO4
- SMILES
-
CCCCCCCCCCCCCOC(=O)C(CC)(CC)C(
=O)OCc1cccc(Cl)c1 - Molecular Weight1
- 467.08
- 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° | -197.69 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -889.64 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 61.69 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 100.03 | kJ/mol | Joback Calculated Property |
| log10WS | -8.89 | Crippen Calculated Property | |
| logPoct/wat | 8.044 | Crippen Calculated Property | |
| McVol | 394.650 | ml/mol | McGowan Calculated Property |
| Pc | 854.96 | kPa | Joback Calculated Property |
| Inp | [3052.00; 3052.00] |
|
|
| Inp | 3052.00 | NIST | |
| Inp | 3052.00 | NIST | |
| Tboil | 1035.60 | K | Joback Calculated Property |
| Tc | 1269.41 | K | Joback Calculated Property |
| Tfus | 609.65 | K | Joback Calculated Property |
| Vc | 1.526 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1332.20; 1412.33] | J/mol×K | [1035.60; 1269.41] |
|
| Cp,gas | 1332.20 | J/mol×K | 1035.60 | Joback Calculated Property |
| Cp,gas | 1348.97 | J/mol×K | 1074.57 | Joback Calculated Property |
| Cp,gas | 1364.25 | J/mol×K | 1113.54 | Joback Calculated Property |
| Cp,gas | 1378.13 | J/mol×K | 1152.50 | Joback Calculated Property |
| Cp,gas | 1390.71 | J/mol×K | 1191.47 | Joback Calculated Property |
| Cp,gas | 1402.08 | J/mol×K | 1230.44 | Joback Calculated Property |
| Cp,gas | 1412.33 | J/mol×K | 1269.41 | Joback Calculated Property |
| η | [0.0000122; 0.0001793] | Pa×s | [609.65; 1035.60] |
|
| η | 0.0001793 | Pa×s | 609.65 | Joback Calculated Property |
| η | 0.0000907 | Pa×s | 680.64 | Joback Calculated Property |
| η | 0.0000522 | Pa×s | 751.63 | Joback Calculated Property |
| η | 0.0000330 | Pa×s | 822.62 | Joback Calculated Property |
| η | 0.0000225 | Pa×s | 893.62 | Joback Calculated Property |
| η | 0.0000162 | Pa×s | 964.61 | Joback Calculated Property |
| η | 0.0000122 | Pa×s | 1035.60 | Joback Calculated Property |
Similar Compounds
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Sources
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