- InChI
- InChI=1S/C18H25ClO4/c1-4-7-11-22-16(20)18(5-2,6-3)17(21)23-13-14-9-8-10-15(19)12-14/h8-10,12H,4-7,11,13H2,1-3H3
- InChI Key
- WROIEGADPRQQMS-UHFFFAOYSA-N
- Formula
- C18H25ClO4
- SMILES
-
CCCCOC(=O)C(CC)(CC)C(=O)OCc1cc
cc(Cl)c1 - Molecular Weight1
- 340.84
- 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° | -273.47 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -703.88 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 38.38 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 80.00 | kJ/mol | Joback Calculated Property |
| log10WS | -5.12 | Crippen Calculated Property | |
| logPoct/wat | 4.533 | Crippen Calculated Property | |
| McVol | 267.840 | ml/mol | McGowan Calculated Property |
| Pc | 1530.66 | kPa | Joback Calculated Property |
| Inp | [2163.00; 2163.00] |
|
|
| Inp | 2163.00 | NIST | |
| Inp | 2163.00 | NIST | |
| Tboil | 829.68 | K | Joback Calculated Property |
| Tc | 1040.23 | K | Joback Calculated Property |
| Tfus | 508.22 | K | Joback Calculated Property |
| Vc | 1.022 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [789.69; 862.29] | J/mol×K | [829.68; 1040.23] |
|
| Cp,gas | 789.69 | J/mol×K | 829.68 | Joback Calculated Property |
| Cp,gas | 804.40 | J/mol×K | 864.77 | Joback Calculated Property |
| Cp,gas | 818.01 | J/mol×K | 899.86 | Joback Calculated Property |
| Cp,gas | 830.56 | J/mol×K | 934.95 | Joback Calculated Property |
| Cp,gas | 842.10 | J/mol×K | 970.04 | Joback Calculated Property |
| Cp,gas | 852.66 | J/mol×K | 1005.13 | Joback Calculated Property |
| Cp,gas | 862.29 | J/mol×K | 1040.23 | Joback Calculated Property |
| η | [0.0000499; 0.0005453] | Pa×s | [508.22; 829.68] |
|
| η | 0.0005453 | Pa×s | 508.22 | Joback Calculated Property |
| η | 0.0003027 | Pa×s | 561.80 | Joback Calculated Property |
| η | 0.0001862 | Pa×s | 615.37 | Joback Calculated Property |
| η | 0.0001238 | Pa×s | 668.95 | Joback Calculated Property |
| η | 0.0000875 | Pa×s | 722.53 | Joback Calculated Property |
| η | 0.0000648 | Pa×s | 776.10 | Joback Calculated Property |
| η | 0.0000499 | Pa×s | 829.68 | Joback Calculated Property |
Similar Compounds
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Sources
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