- InChI
- InChI=1S/C7H3Br2F3/c8-4-1-2-6(9)5(3-4)7(10,11)12/h1-3H
- InChI Key
- VWKFJAOCLPPQGR-UHFFFAOYSA-N
- Formula
- C7H3Br2F3
- SMILES
- FC(F)(F)c1cc(Br)ccc1Br
- Molecular Weight1
- 303.90
- CAS
- 7657-09-2
- Other Names
-
- 2,5-Dibromobenzotrifloride
- Benzene, 1,4-dibromo-2-(trifluoromethyl)-
- Toluene, 2,5-dibromo-alpha,alpha,alpha-trifluoro-
- 1,4-dibromo-2-(trifluoromethyl)benzene
- 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° | -451.74 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -518.64 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 19.55 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 43.90 | kJ/mol | Joback Calculated Property |
| log10WS | -4.90 | Crippen Calculated Property | |
| logPoct/wat | 4.230 | Crippen Calculated Property | |
| McVol | 126.040 | ml/mol | McGowan Calculated Property |
| Pc | 4072.51 | kPa | Joback Calculated Property |
| Tboil | 523.10 | K | Joback Calculated Property |
| Tc | 752.20 | K | Joback Calculated Property |
| Tfus | 343.90 | K | Joback Calculated Property |
| Vc | 0.486 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [232.23; 271.83] | J/mol×K | [523.10; 752.20] | 
|
| Cp,gas | 232.23 | J/mol×K | 523.10 | Joback Calculated Property |
| Cp,gas | 240.60 | J/mol×K | 561.28 | Joback Calculated Property |
| Cp,gas | 248.16 | J/mol×K | 599.47 | Joback Calculated Property |
| Cp,gas | 255.00 | J/mol×K | 637.65 | Joback Calculated Property |
| Cp,gas | 261.18 | J/mol×K | 675.84 | Joback Calculated Property |
| Cp,gas | 266.77 | J/mol×K | 714.02 | Joback Calculated Property |
| Cp,gas | 271.83 | J/mol×K | 752.20 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2,5-Dibromobenzotrifluoride.
Sources
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