Chemical Properties of Benzophenone, 2-hydroxy-4-methoxy-3-methyl (CAS 83803-88-7)

InChI

InChI=1S/C15H14O3/c1-10-13(18-2)9-8-12(14(10)16)15(17)11-6-4-3-5-7-11/h3-9,16H,1-2H3

InChI Key

CUWRRXIHOSRXGN-UHFFFAOYSA-N

Formula

C15H14O3

SMILES

COc1ccc(C(=O)c2ccccc2)c(O)c1C

Molecular Weight¹

242.27

CAS

83803-88-7

Other Names

• 2-hydroxy-4-methoxy-3-methylbenzophenone

• 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	[247.49; 580.00]	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			-2.60200e+01
Coefficient B			1.21544e+00
Coefficient C			-8.47180e-04
Coefficient D			2.37760e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	247.49	J/mol×K	273.00	Calculated Property
Cp,gas	308.47	J/mol×K	353.78	Calculated Property
Cp,gas	361.69	J/mol×K	434.56	Calculated Property
Cp,gas	407.89	J/mol×K	515.33	Calculated Property
Cp,gas	447.84	J/mol×K	596.11	Calculated Property
Cp,gas	482.28	J/mol×K	676.89	Calculated Property
Cp,gas	511.96	J/mol×K	757.67	Calculated Property
Cp,gas	537.64	J/mol×K	838.44	Calculated Property
Cp,gas	560.07	J/mol×K	919.22	Calculated Property
Cp,gas	580.00	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0001540; 0.0000153]	Pa×s	[520.57; 706.51]	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			-1.75539e+01
Coefficient B			4.56822e+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.			520.57
Temperature range, max.			706.51
η	0.0001540	Pa×s	520.57	Calculated Property
η	0.0001102	Pa×s	541.23	Calculated Property
η	0.0000808	Pa×s	561.89	Calculated Property
η	0.0000605	Pa×s	582.55	Calculated Property
η	0.0000463	Pa×s	603.21	Calculated Property
η	0.0000360	Pa×s	623.87	Calculated Property
η	0.0000285	Pa×s	644.53	Calculated Property
η	0.0000229	Pa×s	665.19	Calculated Property
η	0.0000186	Pa×s	685.85	Calculated Property
η	0.0000153	Pa×s	706.51	Calculated Property

Similar Compounds

Find more compounds similar to Benzophenone, 2-hydroxy-4-methoxy-3-methyl.

Sources

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

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