- InChI
- InChI=1S/C6H5F/c7-6-4-2-1-3-5-6/h1-5H
- InChI Key
- PYLWMHQQBFSUBP-UHFFFAOYSA-N
- Formula
- C6H5F
- SMILES
- Fc1ccccc1
- Molecular Weight1
- 96.10
- CAS
- 462-06-6
- Other Names
-
- Fluorobenzene
- Fluorobenzenes
- Monofluorobenzene
- PHENYL FLUORIDE
- UN 2387
- ω : Acentric Factor.
- PAff : Proton affinity (kJ/mol).
- BasG : Gas basicity (kJ/mol).
- ΔcH°liquid : Standard liquid enthalpy of combustion (kJ/mol).
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- Cp,liquid : Liquid phase heat capacity (J/mol×K).
- μ : Dipole Moment (debye).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfH°liquid : Liquid phase enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔfusH : Enthalpy of fusion at a given temperature (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- ΔvapH : Enthalpy of vaporization at a given temperature (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).
- NFPA Fire : NFPA Fire Rating.
- NFPA Health : NFPA Health Rating.
- NFPA Safety : NFPA Safety Rating.
- Pc : Critical Pressure (kPa).
- Pvap : Vapor pressure (kPa).
- n0 : Refractive Index.
- ρl : Liquid Density (kg/m3).
- Inp : Non-polar retention indices.
- I : Polar retention indices.
- ΔfusS : Entropy of fusion at a given temperature (J/mol×K).
- S°liquid : Liquid phase molar entropy at standard conditions (J/mol×K).
- γ : Surface Tension (N/m).
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Ttriple : Triple Point Temperature (K).
- Vc : Critical Volume (m3/kmol).
- Zc : Critical Compressibility.
- Zra : Rackett Parameter.
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ω | 0.2440 | KDB | |
| PAff | 755.90 | kJ/mol | NIST |
| BasG | 726.60 | kJ/mol | NIST |
| ΔcH°liquid | [-3126.00; -3103.90] | kJ/mol |
|
| ΔcH°liquid | -3103.90 ± 1.20 | kJ/mol | NIST |
| ΔcH°liquid | -3126.00 | kJ/mol | NIST |
| μ | 1.40 | debye | KDB |
| ΔfG° | -69.08 | kJ/mol | KDB |
| ΔfH°gas | -116.60 | kJ/mol | KDB |
| ΔfH°liquid | -150.80 ± 1.40 | kJ/mol | NIST |
| ΔfusH° | 8.42 | kJ/mol | Joback Calculated Property |
| ΔvapH° | [34.50; 34.68] | kJ/mol |
|
| ΔvapH° | 34.68 | kJ/mol | NIST |
| ΔvapH° | 34.50 | kJ/mol | NIST |
| ΔvapH° | 34.53 | kJ/mol | NIST |
| ΔvapH° | 34.60 | kJ/mol | NIST |
| IE | [9.11; 9.75] | eV |
|
| IE | 9.20 ± 0.01 | eV | NIST |
| IE | 9.20 | eV | NIST |
| IE | 9.20 | eV | NIST |
| IE | 9.22 | eV | NIST |
| IE | 9.17 | eV | NIST |
| IE | Outlier 9.75 | eV | NIST |
| IE | 9.11 | eV | NIST |
| IE | 9.20 | eV | NIST |
| IE | 9.20 | eV | NIST |
| IE | 9.18 | eV | NIST |
| IE | 9.21 ± 0.04 | eV | NIST |
| IE | 9.20 ± 0.01 | eV | NIST |
| IE | 9.20 | eV | NIST |
| IE | 9.20 ± 0.01 | eV | NIST |
| IE | 9.22 | eV | NIST |
| IE | 9.37 | eV | NIST |
| IE | 9.19 | eV | NIST |
| IE | 9.35 ± 0.03 | eV | NIST |
| log10WS | [-1.80; -1.80] |
|
|
| log10WS | -1.80 | Aq. Sol... | |
| log10WS | -1.80 | Estimat... | |
| logPoct/wat | 1.826 | Crippen Calculated Property | |
| McVol | 73.410 | ml/mol | McGowan Calculated Property |
| NFPA Fire | 3 | KDB | |
| NFPA Health | 2 | KDB | |
| NFPA Safety | 3 | KDB | |
| Pc | [4521.23; 4551.00] | kPa |
|
| Pc | 4551.00 | kPa | KDB |
| Pc | 4550.50 ± 5.06 | kPa | NIST |
| Pc | 4521.23 ± 39.99 | kPa | NIST |
| Inp | [643.00; 684.00] |
|
|
| Inp | 664.90 | NIST | |
| Inp | 671.50 | NIST | |
| Inp | 672.60 | NIST | |
| Inp | 663.20 | NIST | |
| Inp | 668.00 | NIST | |
| Inp | 673.90 | NIST | |
| Inp | 664.60 | NIST | |
| Inp | 666.00 | NIST | |
| Inp | 680.00 | NIST | |
| Inp | 680.00 | NIST | |
| Inp | 671.00 | NIST | |
| Inp | 651.30 | NIST | |
| Inp | Outlier 643.00 | NIST | |
| Inp | 681.00 | NIST | |
| Inp | 664.10 | NIST | |
| Inp | 674.00 | NIST | |
| Inp | 674.00 | NIST | |
| Inp | 659.40 | NIST | |
| Inp | 654.40 | NIST | |
| Inp | 664.00 | NIST | |
| Inp | 664.00 | NIST | |
| Inp | 663.00 | NIST | |
| Inp | 674.00 | NIST | |
| Inp | 681.00 | NIST | |
| Inp | 684.00 | NIST | |
| I | [992.00; 996.00] |
|
|
| I | 996.00 | NIST | |
| I | 992.00 | NIST | |
| S°liquid | [195.00; 205.94] | J/mol×K |
|
| S°liquid | 205.94 | J/mol×K | NIST |
| S°liquid | 195.00 | J/mol×K | NIST |
| Tboil | 357.88 | K | KDB |
| Tc | [557.30; 560.10] | K |
|
| Tc | 560.09 | K | KDB |
| Tc | Outlier 557.30 | K | The Cri... |
| Tc | 560.10 | K | NIST |
| Tc | 560.10 ± 0.20 | K | NIST |
| Tc | 560.07 ± 0.07 | K | NIST |
| Tc | 559.70 ± 0.60 | K | NIST |
| Tfus | [230.94; 231.75] | K |
|
| Tfus | 230.94 | K | KDB |
| Tfus | 231.75 | K | Aq. Sol... |
| Tfus | 230.96 ± 0.06 | K | NIST |
| Tfus | 231.25 ± 0.50 | K | NIST |
| Tfus | 231.30 ± 1.00 | K | NIST |
| Tfus | 231.25 ± 0.40 | K | NIST |
| Ttriple | [230.92; 231.10] | K |
|
| Ttriple | 230.92 ± 0.08 | K | NIST |
| Ttriple | 230.94 ± 0.05 | K | NIST |
| Ttriple | 231.10 ± 0.20 | K | NIST |
| Vc | [0.269; 0.462] | m3/kmol |
|
| Vc | 0.269 | m3/kmol | KDB |
| Vc | 0.269 ± 0.008 | m3/kmol | NIST |
| Vc | 0.462 ± 0.004 | m3/kmol | NIST |
| Zc | 0.2628840 | KDB | |
| Zra | 0.27 | KDB |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [111.67; 160.26] | J/mol×K | [362.63; 563.38] |
|
| Cp,gas | 111.67 | J/mol×K | 362.63 | Joback Calculated Property |
| Cp,gas | 121.05 | J/mol×K | 396.09 | Joback Calculated Property |
| Cp,gas | 129.89 | J/mol×K | 429.55 | Joback Calculated Property |
| Cp,gas | 138.21 | J/mol×K | 463.01 | Joback Calculated Property |
| Cp,gas | 146.03 | J/mol×K | 496.46 | Joback Calculated Property |
| Cp,gas | 153.38 | J/mol×K | 529.92 | Joback Calculated Property |
| Cp,gas | 160.26 | J/mol×K | 563.38 | Joback Calculated Property |
| Cp,liquid | [146.29; 146.57] | J/mol×K | [298.10; 298.15] |
|
| Cp,liquid | 146.57 | J/mol×K | 298.10 | NIST |
| Cp,liquid | 146.29 | J/mol×K | 298.15 | NIST |
| Cp,liquid | 146.36 | J/mol×K | 298.15 | NIST |
| ΔfusH | [10.40; 11.31] | kJ/mol | [230.90; 231.10] |
|
| ΔfusH | 11.31 | kJ/mol | 230.90 | NIST |
| ΔfusH | 11.31 | kJ/mol | 230.90 | NIST |
| ΔfusH | 11.30 | kJ/mol | 230.94 | NIST |
| ΔfusH | 10.40 | kJ/mol | 231.10 | NIST |
| ΔvapH | [29.70; 33.60] | kJ/mol | [318.00; 529.00] |
|
| ΔvapH | 33.50 ± 0.10 | kJ/mol | 318.00 | NIST |
| ΔvapH | 32.40 ± 0.10 | kJ/mol | 337.00 | NIST |
| ΔvapH | 33.60 | kJ/mol | 353.00 | NIST |
| ΔvapH | 31.19 | kJ/mol | 357.90 | NIST |
| ΔvapH | 31.20 ± 0.10 | kJ/mol | 358.00 | NIST |
| ΔvapH | 33.39 | kJ/mol | 358.10 | KDB |
| ΔvapH | 29.70 ± 0.10 | kJ/mol | 382.00 | NIST |
| ΔvapH | 31.80 | kJ/mol | 396.00 | NIST |
| ΔvapH | 31.90 | kJ/mol | 444.00 | NIST |
| ΔvapH | 31.00 | kJ/mol | 457.50 | NIST |
| ΔvapH | 30.90 | kJ/mol | 529.00 | NIST |
| Pvap | [2.98; 12.77] | kPa | [274.20; 303.20] |
|
| Pvap | 2.98 | kPa | 274.20 | Vaporiz... |
| Pvap | 3.64 | kPa | 278.20 | Vaporiz... |
| Pvap | 4.84 | kPa | 283.20 | Vaporiz... |
| Pvap | 6.26 | kPa | 288.20 | Vaporiz... |
| Pvap | 8.02 | kPa | 293.20 | Vaporiz... |
| Pvap | 10.29 | kPa | 298.20 | Vaporiz... |
| Pvap | 12.77 | kPa | 303.20 | Vaporiz... |
| n0 | [1.45630; 1.46300] | [298.15; 313.15] |
|
|
| n0 | 1.46290 | 298.15 | Thermop... | |
| n0 | 1.46300 | 303.15 | Refract... | |
| n0 | 1.45940 | 308.15 | Refract... | |
| n0 | 1.45630 | 313.15 | Refract... | |
| ρl | [985.00; 1036.89] | kg/m3 | [283.15; 330.10] |
|
| ρl | 1036.89 | kg/m3 | 283.15 | The den... |
| ρl | 1030.93 | kg/m3 | 288.15 | The den... |
| ρl | 1024.00 | kg/m3 | 293.00 | KDB |
| ρl | 1024.96 | kg/m3 | 293.15 | The den... |
| ρl | 1022.27 | kg/m3 | 293.20 | Isobari... |
| ρl | 1022.27 | kg/m3 | 293.20 | Isobari... |
| ρl | 1022.00 | kg/m3 | 296.20 | Liquid-... |
| ρl | 1019.07 | kg/m3 | 298.15 | The den... |
| ρl | 1013.03 | kg/m3 | 303.15 | The den... |
| ρl | 985.00 | kg/m3 | 330.10 | Liquid-... |
| ΔfusS | [44.99; 48.95] | J/mol×K | [230.94; 231.10] |
|
| ΔfusS | 48.95 | J/mol×K | 230.94 | NIST |
| ΔfusS | 44.99 | J/mol×K | 231.10 | NIST |
| γ | 0.03 | N/m | 293.20 | KDB |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [0.15; 202.67] | kPa | [230.94; 382.28] |
The Yaw...
|
| Equation | ln(Pvp) = A + B/(T + C) | |||
| Coefficient A | 1.43937e+01 | |||
| Coefficient B | -3.10933e+03 | |||
| Coefficient C | -3.99230e+01 | |||
| Temperature range, min. | 230.94 | |||
| Temperature range, max. | 382.28 | |||
| Pvap | 0.15 | kPa | 230.94 | Calculated Property |
| Pvap | 0.57 | kPa | 247.76 | Calculated Property |
| Pvap | 1.74 | kPa | 264.57 | Calculated Property |
| Pvap | 4.56 | kPa | 281.39 | Calculated Property |
| Pvap | 10.54 | kPa | 298.20 | Calculated Property |
| Pvap | 22.00 | kPa | 315.02 | Calculated Property |
| Pvap | 42.19 | kPa | 331.83 | Calculated Property |
| Pvap | 75.36 | kPa | 348.65 | Calculated Property |
| Pvap | 126.78 | kPa | 365.46 | Calculated Property |
| Pvap | 202.67 | kPa | 382.28 | Calculated Property |
| Pvap | [0.15; 4492.60] | kPa | [230.94; 560.09] |
KDB Vap...
|
| Equation | ln(Pvp) = A + B/T + C*ln(T) + D*T^2 | |||
| Coefficient A | 6.12733e+01 | |||
| Coefficient B | -5.96836e+03 | |||
| Coefficient C | -6.90360e+00 | |||
| Coefficient D | 4.71669e-06 | |||
| Temperature range, min. | 230.94 | |||
| Temperature range, max. | 560.09 | |||
| Pvap | 0.15 | kPa | 230.94 | Calculated Property |
| Pvap | 2.04 | kPa | 267.51 | Calculated Property |
| Pvap | 13.63 | kPa | 304.08 | Calculated Property |
| Pvap | 57.19 | kPa | 340.66 | Calculated Property |
| Pvap | 175.01 | kPa | 377.23 | Calculated Property |
| Pvap | 428.73 | kPa | 413.80 | Calculated Property |
| Pvap | 894.66 | kPa | 450.37 | Calculated Property |
| Pvap | 1659.76 | kPa | 486.95 | Calculated Property |
| Pvap | 2821.49 | kPa | 523.52 | Calculated Property |
| Pvap | 4492.60 | kPa | 560.09 | Calculated Property |
Similar Compounds
Find more compounds similar to Benzene, fluoro-.
Mixtures
- Benzene, fluoro- + Heptane
- Benzene, fluoro- + N-Formylmorpholine
- Disiloxane, 1,3-diethenyl-1,1,3,3-tetramethyl- + Benzene, fluoro-
- Acetic acid, pentyl ester + Benzene, fluoro-
- Benzene, fluoro- + Furan, tetrahydro-2-methyl-
- Benzene, fluoro- + Pentane, 2,2,4-trimethyl-
- Cyclooctane + Benzene, fluoro-
- Ethane, 1,2-dibromo- + Benzene, fluoro-
- Propylene Glycol + Benzene, fluoro-
- Ethanol, 2-methoxy- + Benzene, fluoro-
- Tetrafluoromethane + Benzene, fluoro-
- Fluoroform + Benzene, fluoro-
- Difluoromethane + Benzene, fluoro-
- Methyl fluoride + Benzene, fluoro-
- n-Hexane + Benzene, fluoro-
- Isopropyl Alcohol + Benzene, fluoro- + Water
Sources
- KDB Pure (Korean Thermophysical Properties Databank)
- KDB Vapor Pressure Data
- Crippen Method
- Isobaric vapour liquid equilibria for binary mixtures of n-heptane with bromobenzene, chlorobenzene and fluorobenzene at atmospheric pressure
- Vaporization enthalpies of a series of the fluoro- and chloro-substituted methylbenzenes
- Refractive properties, speed of sound and FT-IR study of binary mixtures of N-formylmorpholine with some halobenzenes at 303.15, 308.15 and 313.15 K
- The density, refractive index, and thermodynamic behaviour of binary mixtures of 1,3-Diethenyl-1,1,3,3-tetramethyldisiloxane with aromatic hydrocarbons
- Thermodynamics of solvation in propylene glycol and methyl cellosolve
- Phase behavior of ionic liquids 1-alkyl-3-methylimidazolium bis(trifluoromethylsulfonyl)imides with halogenated benzenes
- Abraham model correlations for describing the thermodynamic properties of solute transfer into pentyl acetate based on headspace chromatographic and solubility measurements
- Thermophysical properties of the binary mixtures of 2-methyl-tetrahydrofuran with benzene and halobenzenes
- The Critical Temperatures of a Number of (i) (Chloroalkane (C3 C4) + Hydrocarbon (C6 C7)) Binary Mixtures and (ii) (Aromatic Halocarbon (Chlorobenzene, Fluorobenzene, 1,2-Dichlorobenzene, or 1,3-Dichlorobenzene) + Alkane (C8)) Binary Mixtures
- Isobaric Vapor-Liquid Equilibria for Binary Mixtures of 1,2-Dibromoethane with Benzene, Toluene, Fluorobenzene, and Bromobenzene at Atmospheric Pressure
- Solubility of Hydrofluorocarbons in Halobenzene Solvents
- Measurements and Calculation of Vapor-Liquid Equilibria for the Binary Mixtures of Fluorobenzene and Alkanes at a Pressure of 101.4 kPa
- Quantitative Determination of Binodal and Phase Equilibrium Diagrams for the Ternary System (Fluorobenzene + Water + 2-Propanol) at Three Temperatures
- Liquid-Liquid Equilibria in Binary Mixtures Containing Fluorinated Benzenes and Ionic Liquid 1-Ethyl-3-methylimidazolium Bis(trifluoromethylsulfonyl)imide
- Joback Method
- KDB
- Aqueous Solubility Prediction Method
- Estimated Solubility Method
- McGowan Method
- NIST Webbook
- The Yaws Handbook of Vapor Pressure
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