- InChI
- InChI=1S/C12H9F/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9H
- InChI Key
- KLECYOQFQXJYBC-UHFFFAOYSA-N
- Formula
- C12H9F
- SMILES
- Fc1ccccc1-c1ccccc1
- Molecular Weight1
- 172.20
- CAS
- 321-60-8
- Other Names
-
- 2-Fluoro-1,1'-biphenyl
- 2-Fluorobiphenyl
- o-Fluorobiphenyl
- 2-Fluorodiphenyl
- o-Fluorodiphenyl
- Biphenyl, 2-fluoro-
- 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).
- Inp : Non-polar retention indices.
- I : Polar retention indices.
- 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 | 0.3419 | Relay (1.0) Calculated Property | |
| ΔfG° | 70.54 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -10.22 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 17.61 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 66.42 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.20 ± 0.02 | eV | NIST |
| log10WS | -3.79 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.493 | Crippen Calculated Property | |
| McVol | 134.190 | ml/mol | McGowan Calculated Property |
| Pc | 3199.16 | kPa | Joback Calculated Property |
| Inp | [231.69; 1346.00] |
|
|
| Inp | 1346.00 | NIST | |
| Inp | 1346.00 | NIST | |
| Inp | 232.03 | NIST | |
| Inp | 231.69 | NIST | |
| Inp | 233.50 | NIST | |
| I | 226.44 | NIST | |
| Tboil | [521.00; 521.20] | K |
|
| Tboil | 521.00 | K | NIST |
| Tboil | 521.20 | K | NIST |
| Tc | 762.07 | K | Relay (1.0) Calculated Property |
| Tfus | 292.13 | K | Relay (1.0) Calculated Property |
| Vc | 0.507 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [286.80; 361.52] | J/mol×K | [531.57; 769.28] |
|
| Cp,gas | 286.80 | J/mol×K | 531.57 | Joback Calculated Property |
| Cp,gas | 301.89 | J/mol×K | 571.19 | Joback Calculated Property |
| Cp,gas | 315.84 | J/mol×K | 610.81 | Joback Calculated Property |
| Cp,gas | 328.71 | J/mol×K | 650.43 | Joback Calculated Property |
| Cp,gas | 340.58 | J/mol×K | 690.05 | Joback Calculated Property |
| Cp,gas | 351.50 | J/mol×K | 729.66 | Joback Calculated Property |
| Cp,gas | 361.52 | J/mol×K | 769.28 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,1'-Biphenyl, 2-fluoro-.
Sources
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