- InChI
- InChI=1S/C12H17F/c1-12(2,3)11-6-4-10(5-7-11)8-9-13/h4-7H,8-9H2,1-3H3
- InChI Key
- FCVVNGVMGCBLKR-UHFFFAOYSA-N
- Formula
- C12H17F
- SMILES
- CC(C)(C)c1ccc(CCF)cc1
- Molecular Weight1
- 180.26
- 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).
- Inp : Non-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 |
|---|---|---|---|
| ΔfG° | -39.03 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -270.81 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 16.15 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 43.13 | kJ/mol | Joback Calculated Property |
| log10WS | -3.44 | Crippen Calculated Property | |
| logPoct/wat | 3.496 | Crippen Calculated Property | |
| McVol | 157.950 | ml/mol | McGowan Calculated Property |
| Pc | 2311.39 | kPa | Joback Calculated Property |
| Inp | 1262.00 | NIST | |
| Tboil | 501.66 | K | Joback Calculated Property |
| Tc | 704.23 | K | Joback Calculated Property |
| Tfus | 266.95 | K | Joback Calculated Property |
| Vc | 0.607 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [357.25; 444.70] | J/mol×K | [501.66; 704.23] | 
|
| Cp,gas | 357.25 | J/mol×K | 501.66 | Joback Calculated Property |
| Cp,gas | 374.20 | J/mol×K | 535.42 | Joback Calculated Property |
| Cp,gas | 390.13 | J/mol×K | 569.18 | Joback Calculated Property |
| Cp,gas | 405.10 | J/mol×K | 602.95 | Joback Calculated Property |
| Cp,gas | 419.15 | J/mol×K | 636.71 | Joback Calculated Property |
| Cp,gas | 432.34 | J/mol×K | 670.47 | Joback Calculated Property |
| Cp,gas | 444.70 | J/mol×K | 704.23 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzene, 1-(1,1-dimethylethyl)-4-(2-fluoroethyl).
Sources
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