Chemical Properties of Benzhydrol, 4,4'-dichloro-alpha-fluoromethyl-

InChI

InChI=1S/C14H11Cl2FO/c15-12-5-1-10(2-6-12)14(18,9-17)11-3-7-13(16)8-4-11/h1-8,18H,9H2

InChI Key

RPYHUOWLWZFZBP-UHFFFAOYSA-N

Formula

C14H11Cl2FO

SMILES

OC(CF)(c1ccc(Cl)cc1)c1ccc(Cl)cc1

Molecular Weight¹

285.14

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• IE : Ionization energy (eV).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• T_boil : Normal Boiling Point Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[239.11; 542.22]	J/mol×K	[273.00; 1000.00]	Joback Predicted correlation
Equation			Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K
Coefficient A			-3.63590e+01
Coefficient B			1.24220e+00
Coefficient C			-9.25520e-04
Coefficient D			2.61900e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	239.11	J/mol×K	273.00	Calculated Property
Cp,gas	298.86	J/mol×K	353.78	Calculated Property
Cp,gas	350.16	J/mol×K	434.56	Calculated Property
Cp,gas	393.84	J/mol×K	515.33	Calculated Property
Cp,gas	430.73	J/mol×K	596.11	Calculated Property
Cp,gas	461.64	J/mol×K	676.89	Calculated Property
Cp,gas	487.42	J/mol×K	757.67	Calculated Property
Cp,gas	508.89	J/mol×K	838.44	Calculated Property
Cp,gas	526.88	J/mol×K	919.22	Calculated Property
Cp,gas	542.22	J/mol×K	1000.00	Calculated Property

Similar Compounds

Find more compounds similar to Benzhydrol, 4,4'-dichloro-alpha-fluoromethyl-.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
Calculated This icon marks a calculated value or equation: a prediction, not a measurement.
These property values are available through the Cheméo API. A free account gives you an access key.