Chemical Properties of Naphthalene, 2-hydroxy-6-benzoyl- (CAS 52222-87-4)

InChI

InChI=1S/C17H12O2/c18-16-9-8-13-10-15(7-6-14(13)11-16)17(19)12-4-2-1-3-5-12/h1-11,18H

InChI Key

MJKZGSBXCWNUHV-UHFFFAOYSA-N

Formula

C17H12O2

SMILES

O=C(c1ccccc1)c1ccc2cc(O)ccc2c1

Molecular Weight¹

248.28

CAS

52222-87-4

Other Names

• 6-Benzoyl-2-naphthol
• 6-hydroxy-2-naphthyl phenyl ketone
• Ketone, 6-hydroxy-2-naphthyl phenyl
• Methanone, (6-hydroxy-2-naphthalenyl) phenyl

• 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_vapH° : Enthalpy of vaporization 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).
• 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.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[230.97; 576.94]	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			-9.90800e+01
Coefficient B			1.52440e+00
Coefficient C			-1.27074e-03
Coefficient D			4.22360e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	230.97	J/mol×K	273.00	Calculated Property
Cp,gas	299.88	J/mol×K	353.78	Calculated Property
Cp,gas	358.05	J/mol×K	434.56	Calculated Property
Cp,gas	406.83	J/mol×K	515.33	Calculated Property
Cp,gas	447.54	J/mol×K	596.11	Calculated Property
Cp,gas	481.53	J/mol×K	676.89	Calculated Property
Cp,gas	510.13	J/mol×K	757.67	Calculated Property
Cp,gas	534.67	J/mol×K	838.44	Calculated Property
Cp,gas	556.50	J/mol×K	919.22	Calculated Property
Cp,gas	576.94	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0002242; 0.0000239]	Pa×s	[541.06; 747.18]	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			-1.65134e+01
Coefficient B			4.38815e+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.			541.06
Temperature range, max.			747.18
η	0.0002242	Pa×s	541.06	Calculated Property
η	0.0001613	Pa×s	563.96	Calculated Property
η	0.0001190	Pa×s	586.87	Calculated Property
η	0.0000899	Pa×s	609.77	Calculated Property
η	0.0000693	Pa×s	632.67	Calculated Property
η	0.0000544	Pa×s	655.57	Calculated Property
η	0.0000434	Pa×s	678.48	Calculated Property
η	0.0000351	Pa×s	701.38	Calculated Property
η	0.0000288	Pa×s	724.28	Calculated Property
η	0.0000239	Pa×s	747.18	Calculated Property

Similar Compounds

Find more compounds similar to Naphthalene, 2-hydroxy-6-benzoyl-.

Sources

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

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