- InChI
- InChI=1S/C20H21ClO5/c1-3-4-11-25-19(22)16-7-5-6-8-17(16)20(23)26-13-14-9-10-15(21)12-18(14)24-2/h5-10,12H,3-4,11,13H2,1-2H3
- InChI Key
- TYAMFYZWYVZNMV-UHFFFAOYSA-N
- Formula
- C20H21ClO5
- SMILES
-
CCCCOC(=O)c1ccccc1C(=O)OCc1ccc
(Cl)cc1OC - Molecular Weight1
- 376.83
- 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° | -271.32 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -655.04 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 45.43 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 91.76 | kJ/mol | Joback Calculated Property |
| log10WS | -6.13 | Crippen Calculated Property | |
| logPoct/wat | 4.662 | Crippen Calculated Property | |
| McVol | 278.130 | ml/mol | McGowan Calculated Property |
| Pc | 1621.98 | kPa | Joback Calculated Property |
| Inp | [2679.00; 2679.00] |
|
|
| Inp | 2679.00 | NIST | |
| Inp | 2679.00 | NIST | |
| Tboil | 937.73 | K | Joback Calculated Property |
| Tc | 1166.24 | K | Joback Calculated Property |
| Tfus | 602.03 | K | Joback Calculated Property |
| Vc | 1.054 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [828.29; 877.80] | J/mol×K | [937.73; 1166.24] |
|
| Cp,gas | 828.29 | J/mol×K | 937.73 | Joback Calculated Property |
| Cp,gas | 840.05 | J/mol×K | 975.82 | Joback Calculated Property |
| Cp,gas | 850.40 | J/mol×K | 1013.90 | Joback Calculated Property |
| Cp,gas | 859.33 | J/mol×K | 1051.99 | Joback Calculated Property |
| Cp,gas | 866.87 | J/mol×K | 1090.07 | Joback Calculated Property |
| Cp,gas | 873.03 | J/mol×K | 1128.16 | Joback Calculated Property |
| Cp,gas | 877.80 | J/mol×K | 1166.24 | Joback Calculated Property |
| η | [0.0000377; 0.0002436] | Pa×s | [602.03; 937.73] |
|
| η | 0.0002436 | Pa×s | 602.03 | Joback Calculated Property |
| η | 0.0001564 | Pa×s | 657.98 | Joback Calculated Property |
| η | 0.0001076 | Pa×s | 713.93 | Joback Calculated Property |
| η | 0.0000782 | Pa×s | 769.88 | Joback Calculated Property |
| η | 0.0000594 | Pa×s | 825.83 | Joback Calculated Property |
| η | 0.0000466 | Pa×s | 881.78 | Joback Calculated Property |
| η | 0.0000377 | Pa×s | 937.73 | Joback Calculated Property |
Similar Compounds
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Sources
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