- InChI
- InChI=1S/C7H3Cl3O/c8-4-1-2-5(7(10)11)6(9)3-4/h1-3H
- InChI Key
- CEOCVKWBUWKBKA-UHFFFAOYSA-N
- Formula
- C7H3Cl3O
- SMILES
- O=C(Cl)c1ccc(Cl)cc1Cl
- Molecular Weight1
- 209.46
- CAS
- 89-75-8
- Other Names
-
- 2,4-Dichlorobenzoyl 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° | -63.50 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -134.02 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 21.34 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 54.68 | kJ/mol | Joback Calculated Property |
| log10WS | -3.73 | Crippen Calculated Property | |
| logPoct/wat | 3.372 | Crippen Calculated Property | |
| McVol | 124.020 | ml/mol | McGowan Calculated Property |
| Pc | 3731.66 | kPa | Joback Calculated Property |
| Tboil | 562.36 | K | Joback Calculated Property |
| Tc | 806.32 | K | Joback Calculated Property |
| Tfus | 359.80 | K | Joback Calculated Property |
| Vc | 0.472 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [215.68; 252.44] | J/mol×K | [562.36; 806.32] | 
|
| Cp,gas | 215.68 | J/mol×K | 562.36 | Joback Calculated Property |
| Cp,gas | 223.19 | J/mol×K | 603.02 | Joback Calculated Property |
| Cp,gas | 230.11 | J/mol×K | 643.68 | Joback Calculated Property |
| Cp,gas | 236.47 | J/mol×K | 684.34 | Joback Calculated Property |
| Cp,gas | 242.29 | J/mol×K | 725.00 | Joback Calculated Property |
| Cp,gas | 247.61 | J/mol×K | 765.66 | Joback Calculated Property |
| Cp,gas | 252.44 | J/mol×K | 806.32 | Joback Calculated Property |
| η | [0.0003139; 0.0016548] | Pa×s | [359.80; 562.36] |
|
| η | 0.0016548 | Pa×s | 359.80 | Joback Calculated Property |
| η | 0.0011138 | Pa×s | 393.56 | Joback Calculated Property |
| η | 0.0007980 | Pa×s | 427.32 | Joback Calculated Property |
| η | 0.0006004 | Pa×s | 461.08 | Joback Calculated Property |
| η | 0.0004696 | Pa×s | 494.84 | Joback Calculated Property |
| η | 0.0003790 | Pa×s | 528.60 | Joback Calculated Property |
| η | 0.0003139 | Pa×s | 562.36 | Joback Calculated Property |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 423.20 | K | 4.50 | NIST |
Similar Compounds
Find more compounds similar to Benzoyl chloride, 2,4-dichloro-.
Sources
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