- InChI
- InChI=1S/C6H3ClF2/c7-5-2-1-4(8)3-6(5)9/h1-3H
- InChI Key
- AJCSNHQKXUSMMY-UHFFFAOYSA-N
- Formula
- C6H3ClF2
- SMILES
- Fc1ccc(Cl)c(F)c1
- Molecular Weight1
- 148.54
- CAS
- 1435-44-5
- Other Names
-
- Benzene,1-chloro-2,4-difluoro-
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- 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 | 0.3178 | Relay (1.0) Calculated Property | |
| ΔfG° | -308.76 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -305.70 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 14.92 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 43.57 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.17 ± 0.02 | eV | NIST |
| log10WS | -2.62 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.618 | Crippen Calculated Property | |
| McVol | 87.420 | ml/mol | McGowan Calculated Property |
| Pc | 3810.39 | kPa | Joback Calculated Property |
| Tboil | 400.20 | K | NIST |
| Tc | 621.74 | K | Relay (1.0) Calculated Property |
| Tfus | 256.47 | K | Relay (1.0) Calculated Property |
| Vc | 0.338 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [144.97; 183.71] | J/mol×K | [409.29; 610.29] | 
|
| Cp,gas | 144.97 | J/mol×K | 409.29 | Joback Calculated Property |
| Cp,gas | 152.39 | J/mol×K | 442.79 | Joback Calculated Property |
| Cp,gas | 159.40 | J/mol×K | 476.29 | Joback Calculated Property |
| Cp,gas | 166.03 | J/mol×K | 509.79 | Joback Calculated Property |
| Cp,gas | 172.28 | J/mol×K | 543.29 | Joback Calculated Property |
| Cp,gas | 178.17 | J/mol×K | 576.79 | Joback Calculated Property |
| Cp,gas | 183.71 | J/mol×K | 610.29 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1-Chloro-2,4-difluorobenzene.
Sources
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