- InChI
- InChI=1S/C17H24Cl2O5/c1-2-3-7-21-10-11-22-8-4-9-23-17(20)13-24-16-6-5-14(18)12-15(16)19/h5-6,12H,2-4,7-11,13H2,1H3
- InChI Key
- RJKOZHSBYKYUJB-UHFFFAOYSA-N
- Formula
- C17H24Cl2O5
- SMILES
-
CCCCOCCOCCCOC(=O)COc1ccc(Cl)cc
1Cl - Molecular Weight1
- 379.27
- CAS
- 1928-57-0
- ω : Acentric Factor.
- 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).
- IE : Ionization energy (eV).
- 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).
- 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 |
|---|---|---|---|
| ω | 0.9699 | Relay (... Calculated Property | |
| ΔfG° | -387.37 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -900.53 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 47.79 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 107.88 | kJ/mol | Relay (... Calculated Property |
| IE | 8.43 | eV | Relay (... Calculated Property |
| log10WS | -4.52 | Relay (... Calculated Property | |
| logPoct/wat | 4.139 | Crippen Calculated Property | |
| McVol | 276.160 | ml/mol | McGowan Calculated Property |
| Pc | 1447.94 | kPa | Joback Calculated Property |
| Tboil | 646.56 | K | Relay (... Calculated Property |
| Tc | 855.57 | K | Relay (... Calculated Property |
| Tfus | 292.36 | K | Relay (... Calculated Property |
| Vc | 1.016 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [796.65; 862.85] | J/mol×K | [843.41; 1046.59] | 
|
| Cp,gas | 796.65 | J/mol×K | 843.41 | Joback Calculated Property |
| Cp,gas | 810.53 | J/mol×K | 877.27 | Joback Calculated Property |
| Cp,gas | 823.28 | J/mol×K | 911.14 | Joback Calculated Property |
| Cp,gas | 834.90 | J/mol×K | 945.00 | Joback Calculated Property |
| Cp,gas | 845.38 | J/mol×K | 978.86 | Joback Calculated Property |
| Cp,gas | 854.70 | J/mol×K | 1012.73 | Joback Calculated Property |
| Cp,gas | 862.85 | J/mol×K | 1046.59 | Joback Calculated Property |
| η | [0.0000370; 0.0002821] | Pa×s | [531.50; 843.41] |
|
| η | 0.0002821 | Pa×s | 531.50 | Joback Calculated Property |
| η | 0.0001729 | Pa×s | 583.49 | Joback Calculated Property |
| η | 0.0001149 | Pa×s | 635.47 | Joback Calculated Property |
| η | 0.0000811 | Pa×s | 687.45 | Joback Calculated Property |
| η | 0.0000602 | Pa×s | 739.44 | Joback Calculated Property |
| η | 0.0000465 | Pa×s | 791.42 | Joback Calculated Property |
| η | 0.0000370 | Pa×s | 843.41 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2,4-Dichlorophenoxyacetic acid, 3-(2-butoxyethoxy) propyl ester.
Sources
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