Chemical Properties of (5-Chloro-2-hydroxyphenyl)(phenyl)methanone (CAS 85-19-8)

InChI

InChI=1S/C13H9ClO2/c14-10-6-7-12(15)11(8-10)13(16)9-4-2-1-3-5-9/h1-8,15H

InChI Key

OMWSZDODENFLSV-UHFFFAOYSA-N

Formula

C13H9ClO2

SMILES

O=C(c1ccccc1)c1cc(Cl)ccc1O

Molecular Weight¹

232.66

CAS

85-19-8

Other Names

• Phenol, 2-benzoyl-4-chloro-
• 5-chloro-2-hydroxybenzophenone

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_subH : Enthalpy of sublimation at a given temperature (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• Δ_vapH : Enthalpy of vaporization at a given temperature (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).
• P_c : Critical Pressure (kPa).
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical 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 Volume, 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.

Temperature Dependent Properties

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[200.52; 469.63]	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			-5.11100e+01
Coefficient B			1.15490e+00
Coefficient C			-9.36820e-04
Coefficient D			3.02660e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	200.52	J/mol×K	273.00	Calculated Property
Cp,gas	253.62	J/mol×K	353.78	Calculated Property
Cp,gas	298.69	J/mol×K	434.56	Calculated Property
Cp,gas	336.68	J/mol×K	515.33	Calculated Property
Cp,gas	368.55	J/mol×K	596.11	Calculated Property
Cp,gas	395.26	J/mol×K	676.89	Calculated Property
Cp,gas	417.77	J/mol×K	757.67	Calculated Property
Cp,gas	437.03	J/mol×K	838.44	Calculated Property
Cp,gas	454.00	J/mol×K	919.22	Calculated Property
Cp,gas	469.63	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0002993; 0.0000217]	Pa×s	[493.20; 693.31]	Joback Predicted correlation
Equation			Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K
Coefficient A			-1.71984e+01
Coefficient B			4.48039e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Comment			Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc.
Temperature range, min.			493.20
Temperature range, max.			693.31
η	0.0002993	Pa×s	493.20	Calculated Property
η	0.0002023	Pa×s	515.43	Calculated Property
η	0.0001412	Pa×s	537.67	Calculated Property
η	0.0001014	Pa×s	559.90	Calculated Property
η	0.0000747	Pa×s	582.14	Calculated Property
η	0.0000563	Pa×s	604.37	Calculated Property
η	0.0000433	Pa×s	626.60	Calculated Property
η	0.0000339	Pa×s	648.84	Calculated Property
η	0.0000269	Pa×s	671.07	Calculated Property
η	0.0000217	Pa×s	693.31	Calculated Property

Similar Compounds

Find more compounds similar to (5-Chloro-2-hydroxyphenyl)(phenyl)methanone.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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