- InChI
- InChI=1S/C8H8BrCl/c9-6-5-7-1-3-8(10)4-2-7/h1-4H,5-6H2
- InChI Key
- YAFMYKFAUNCQPU-UHFFFAOYSA-N
- Formula
- C8H8BrCl
- SMILES
- Clc1ccc(CCBr)cc1
- Molecular Weight1
- 219.51
- CAS
- 6529-53-9
- Other Names
-
- p-Chloro-«beta»-phenethyl bromide
- p-Chlorophenethyl bromide
- 1-(2-Bromoethyl)-4-chlorobenzene
- 2-(p-Chlorophenyl)ethyl bromide
- 4-Chlorophenethyl bromide
- 1-Bromo-2-(4-chlorophenyl)ethane
- 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 | 0.4733 | Relay (1.0) Calculated Property | |
| ΔfG° | 121.65 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 24.50 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 19.61 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 63.85 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.80 | eV | NIST |
| log10WS | -3.82 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.277 | Crippen Calculated Property | |
| McVol | 129.560 | ml/mol | McGowan Calculated Property |
| Pc | 3727.11 | kPa | Joback Calculated Property |
| Tboil | 525.27 | K | Relay (1.0) Calculated Property |
| Tc | 729.28 | K | Relay (1.0) Calculated Property |
| Tfus | 286.87 | K | Relay (1.0) Calculated Property |
| Vc | 0.454 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [236.61; 291.42] | J/mol×K | [517.69; 752.93] | 
|
| Cp,gas | 236.61 | J/mol×K | 517.69 | Joback Calculated Property |
| Cp,gas | 247.55 | J/mol×K | 556.90 | Joback Calculated Property |
| Cp,gas | 257.70 | J/mol×K | 596.10 | Joback Calculated Property |
| Cp,gas | 267.11 | J/mol×K | 635.31 | Joback Calculated Property |
| Cp,gas | 275.84 | J/mol×K | 674.52 | Joback Calculated Property |
| Cp,gas | 283.93 | J/mol×K | 713.72 | Joback Calculated Property |
| Cp,gas | 291.42 | J/mol×K | 752.93 | Joback Calculated Property |
| η | [0.0002907; 0.0020762] | Pa×s | [308.58; 517.69] |
|
| η | 0.0020762 | Pa×s | 308.58 | Joback Calculated Property |
| η | 0.0012669 | Pa×s | 343.43 | Joback Calculated Property |
| η | 0.0008468 | Pa×s | 378.28 | Joback Calculated Property |
| η | 0.0006058 | Pa×s | 413.14 | Joback Calculated Property |
| η | 0.0004565 | Pa×s | 447.99 | Joback Calculated Property |
| η | 0.0003584 | Pa×s | 482.84 | Joback Calculated Property |
| η | 0.0002907 | Pa×s | 517.69 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzene, 1-(2-bromoethyl)-4-chloro-.
Sources
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