- InChI
- InChI=1S/C8H6Cl2O/c9-7(8(10)11)6-4-2-1-3-5-6/h1-5,7H
- InChI Key
- FGEAOSXMQZWHIQ-UHFFFAOYSA-N
- Formula
- C8H6Cl2O
- SMILES
- O=C(Cl)C(Cl)c1ccccc1
- Molecular Weight1
- 189.04
- CAS
- 2912-62-1
- Other Names
-
- a-Chlorophenylacetyl chloride
- Benzeneacetyl chloride, «alpha»-chloro-
- DL-2-Chloro-2-phenylacetyl chloride
- chloro(phenyl)acetyl chloride
- 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).
- Tboilr : Boiling point at reduced pressure (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° | -26.33 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -121.26 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 16.99 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 50.81 | kJ/mol | Joback Calculated Property |
| log10WS | -2.81 | Crippen Calculated Property | |
| logPoct/wat | 2.732 | Crippen Calculated Property | |
| McVol | 125.870 | ml/mol | McGowan Calculated Property |
| Pc | 3637.73 | kPa | Joback Calculated Property |
| Tboil | 537.41 | K | Joback Calculated Property |
| Tc | 775.44 | K | Joback Calculated Property |
| Tfus | 301.11 | K | Joback Calculated Property |
| Vc | 0.473 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [239.85; 291.33] | J/mol×K | [537.41; 775.44] | 
|
| Cp,gas | 239.85 | J/mol×K | 537.41 | Joback Calculated Property |
| Cp,gas | 250.36 | J/mol×K | 577.08 | Joback Calculated Property |
| Cp,gas | 260.03 | J/mol×K | 616.75 | Joback Calculated Property |
| Cp,gas | 268.93 | J/mol×K | 656.42 | Joback Calculated Property |
| Cp,gas | 277.08 | J/mol×K | 696.09 | Joback Calculated Property |
| Cp,gas | 284.53 | J/mol×K | 735.76 | Joback Calculated Property |
| Cp,gas | 291.33 | J/mol×K | 775.44 | Joback Calculated Property |
| η | [0.0002912; 0.0036093] | Pa×s | [301.11; 537.41] |
|
| η | 0.0036093 | Pa×s | 301.11 | Joback Calculated Property |
| η | 0.0018614 | Pa×s | 340.49 | Joback Calculated Property |
| η | 0.0011013 | Pa×s | 379.88 | Joback Calculated Property |
| η | 0.0007191 | Pa×s | 419.26 | Joback Calculated Property |
| η | 0.0005052 | Pa×s | 458.64 | Joback Calculated Property |
| η | 0.0003753 | Pa×s | 498.03 | Joback Calculated Property |
| η | 0.0002912 | Pa×s | 537.41 | Joback Calculated Property |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | [393.20; 395.50] | K | [2.70; 3.10] |
|
| Tboilr | 395.50 ± 2.50 | K | 2.70 | NIST |
| Tboilr | 393.20 | K | 3.10 | NIST |
Similar Compounds
Find more compounds similar to «alpha»-Chlorophenylacetyl chloride.
Sources
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