- InChI
- InChI=1S/C11H11BrCl2O3/c1-11(13,14)10(15)17-7-6-16-9-4-2-8(12)3-5-9/h2-5H,6-7H2,1H3
- InChI Key
- KQILBCATKAJIDX-UHFFFAOYSA-N
- Formula
- C11H11BrCl2O3
- SMILES
-
CC(Cl)(Cl)C(=O)OCCOc1ccc(Br)cc
1 - Molecular Weight1
- 342.01
- CAS
- 99852-98-9
- 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).
- 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° | -201.10 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -436.23 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 28.14 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 68.49 | kJ/mol | Joback Calculated Property |
| log10WS | -4.20 | Crippen Calculated Property | |
| logPoct/wat | 3.565 | Crippen Calculated Property | |
| McVol | 197.380 | ml/mol | McGowan Calculated Property |
| Pc | 2726.86 | kPa | Joback Calculated Property |
| Tboil | 719.24 | K | Joback Calculated Property |
| Tc | 957.76 | K | Joback Calculated Property |
| Tfus | 469.12 | K | Joback Calculated Property |
| Vc | 0.735 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [458.29; 511.80] | J/mol×K | [719.24; 957.76] | 
|
| Cp,gas | 458.29 | J/mol×K | 719.24 | Joback Calculated Property |
| Cp,gas | 469.39 | J/mol×K | 758.99 | Joback Calculated Property |
| Cp,gas | 479.55 | J/mol×K | 798.75 | Joback Calculated Property |
| Cp,gas | 488.83 | J/mol×K | 838.50 | Joback Calculated Property |
| Cp,gas | 497.26 | J/mol×K | 878.25 | Joback Calculated Property |
| Cp,gas | 504.90 | J/mol×K | 918.00 | Joback Calculated Property |
| Cp,gas | 511.80 | J/mol×K | 957.76 | Joback Calculated Property |
| η | [0.0000997; 0.0007303] | Pa×s | [469.12; 719.24] |
|
| η | 0.0007303 | Pa×s | 469.12 | Joback Calculated Property |
| η | 0.0004576 | Pa×s | 510.81 | Joback Calculated Property |
| η | 0.0003077 | Pa×s | 552.49 | Joback Calculated Property |
| η | 0.0002188 | Pa×s | 594.18 | Joback Calculated Property |
| η | 0.0001627 | Pa×s | 635.87 | Joback Calculated Property |
| η | 0.0001254 | Pa×s | 677.55 | Joback Calculated Property |
| η | 0.0000997 | Pa×s | 719.24 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2(P-bromophenoxy)ethyl alpha,alpha-dichloropropionate.
Sources
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