- InChI
- InChI=1S/C3HBrF6/c4-2(6,7)1(5)3(8,9)10/h1H
- InChI Key
- UBSZSCBAJXCXOO-UHFFFAOYSA-N
- Formula
- C3HBrF6
- SMILES
- FC(C(F)(F)F)C(F)(F)Br
- Molecular Weight1
- 230.93
- CAS
- 2252-78-0
- 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° | -1176.92 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1278.36 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 8.94 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 20.82 | kJ/mol | Joback Calculated Property |
| log10WS | -2.95 | Crippen Calculated Property | |
| logPoct/wat | 2.875 | Crippen Calculated Property | |
| McVol | 81.250 | ml/mol | McGowan Calculated Property |
| Pc | 3624.61 | kPa | Joback Calculated Property |
| Tboil | 308.60 | K | NIST |
| Tc | 476.41 | K | Joback Calculated Property |
| Tfus | 176.75 | K | Joback Calculated Property |
| Vc | 0.345 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [145.40; 183.03] | J/mol×K | [322.92; 476.41] | 
|
| Cp,gas | 145.40 | J/mol×K | 322.92 | Joback Calculated Property |
| Cp,gas | 152.94 | J/mol×K | 348.50 | Joback Calculated Property |
| Cp,gas | 159.93 | J/mol×K | 374.08 | Joback Calculated Property |
| Cp,gas | 166.42 | J/mol×K | 399.66 | Joback Calculated Property |
| Cp,gas | 172.42 | J/mol×K | 425.24 | Joback Calculated Property |
| Cp,gas | 177.95 | J/mol×K | 450.82 | Joback Calculated Property |
| Cp,gas | 183.03 | J/mol×K | 476.41 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1-Bromo-1,1,2,3,3,3-hexafluoropropane.
Sources
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