- InChI
- InChI=1S/C8H10FN/c1-6(10)7-2-4-8(9)5-3-7/h2-6H,10H2,1H3
- InChI Key
- QGCLEUGNYRXBMZ-UHFFFAOYSA-N
- Formula
- C8H10FN
- SMILES
- CC(N)c1ccc(F)cc1
- Molecular Weight1
- 139.17
- CAS
- 403-40-7
- 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).
- 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 | 0.3976 | Relay (1.0) Calculated Property | |
| ΔfG° | -11.54 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -173.28 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 14.88 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 56.84 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.57 | eV | Relay (1.0) Calculated Property |
| log10WS | -1.38 | Relay (1.0) Calculated Property | |
| logPoct/wat | 1.845 | Crippen Calculated Property | |
| McVol | 111.570 | ml/mol | McGowan Calculated Property |
| Pc | 3673.09 | kPa | Joback Calculated Property |
| Tboil | 450.47 | K | Relay (1.0) Calculated Property |
| Tc | 663.81 | K | Relay (1.0) Calculated Property |
| Tfus | 274.50 | K | Relay (1.0) Calculated Property |
| Vc | 0.388 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [237.33; 300.76] | J/mol×K | [485.46; 702.91] | 
|
| Cp,gas | 237.33 | J/mol×K | 485.46 | Joback Calculated Property |
| Cp,gas | 249.65 | J/mol×K | 521.70 | Joback Calculated Property |
| Cp,gas | 261.24 | J/mol×K | 557.94 | Joback Calculated Property |
| Cp,gas | 272.11 | J/mol×K | 594.19 | Joback Calculated Property |
| Cp,gas | 282.30 | J/mol×K | 630.43 | Joback Calculated Property |
| Cp,gas | 291.85 | J/mol×K | 666.67 | Joback Calculated Property |
| Cp,gas | 300.76 | J/mol×K | 702.91 | Joback Calculated Property |
Similar Compounds
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Sources
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