- InChI
- InChI=1S/C7H5BrF2/c8-4-5-2-1-3-6(9)7(5)10/h1-3H,4H2
- InChI Key
- FTBSGSZZESQDBM-UHFFFAOYSA-N
- Formula
- C7H5BrF2
- SMILES
- Fc1cccc(CBr)c1F
- Molecular Weight1
- 207.01
- CAS
- 113211-94-2
- 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).
- 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° | -274.09 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -340.11 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 18.59 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 39.58 | kJ/mol | Joback Calculated Property |
| log10WS | -3.45 | Crippen Calculated Property | |
| logPoct/wat | 2.860 | Crippen Calculated Property | |
| McVol | 106.770 | ml/mol | McGowan Calculated Property |
| Pc | 3857.88 | kPa | Joback Calculated Property |
| Tboil | 460.90 | K | Joback Calculated Property |
| Tc | 671.11 | K | Joback Calculated Property |
| Tfus | 281.09 | K | Joback Calculated Property |
| Vc | 0.417 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [190.11; 235.85] | J/mol×K | [460.90; 671.11] | 
|
| Cp,gas | 190.11 | J/mol×K | 460.90 | Joback Calculated Property |
| Cp,gas | 199.00 | J/mol×K | 495.93 | Joback Calculated Property |
| Cp,gas | 207.35 | J/mol×K | 530.97 | Joback Calculated Property |
| Cp,gas | 215.19 | J/mol×K | 566.00 | Joback Calculated Property |
| Cp,gas | 222.54 | J/mol×K | 601.04 | Joback Calculated Property |
| Cp,gas | 229.41 | J/mol×K | 636.07 | Joback Calculated Property |
| Cp,gas | 235.85 | J/mol×K | 671.11 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2,3-Difluorobenzyl bromide.
Sources
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