- InChI
- InChI=1S/C6H10BrF/c7-5-3-1-2-4-6(5)8/h5-6H,1-4H2/t5-,6+/m0/s1
- InChI Key
- AZQRVGXSORXOCR-NTSWFWBYSA-N
- Formula
- C6H10BrF
- SMILES
- FC1CCCCC1Br
- Molecular Weight1
- 181.05
- CAS
- 51422-74-3
- Other Names
-
- cis-1-Bromo-2-Fluorocyclohexane
- cis-2-Fluorocyclohexyl Bromide
- 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 |
|---|---|---|---|
| ΔfG° | -164.11 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -302.97 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 12.57 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 34.69 | kJ/mol | Joback Calculated Property |
| IE | [10.04; 10.06] | eV |
|
| IE | 10.04 ± 0.02 | eV | NIST |
| IE | 10.06 | eV | NIST |
| log10WS | -2.74 | Crippen Calculated Property | |
| logPoct/wat | 2.662 | Crippen Calculated Property | |
| McVol | 103.810 | ml/mol | McGowan Calculated Property |
| Pc | 3916.03 | kPa | Joback Calculated Property |
| Tboil | 416.99 | K | Joback Calculated Property |
| Tc | 630.08 | K | Joback Calculated Property |
| Tfus | 220.91 | K | Joback Calculated Property |
| Vc | 0.384 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [185.59; 260.51] | J/mol×K | [416.99; 630.08] |
|
| Cp,gas | 185.59 | J/mol×K | 416.99 | Joback Calculated Property |
| Cp,gas | 199.93 | J/mol×K | 452.50 | Joback Calculated Property |
| Cp,gas | 213.50 | J/mol×K | 488.02 | Joback Calculated Property |
| Cp,gas | 226.33 | J/mol×K | 523.53 | Joback Calculated Property |
| Cp,gas | 238.42 | J/mol×K | 559.05 | Joback Calculated Property |
| Cp,gas | 249.81 | J/mol×K | 594.56 | Joback Calculated Property |
| Cp,gas | 260.51 | J/mol×K | 630.08 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Cyclohexane, 1-bromo-2-fluoro-, cis-.
Sources
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