Chemical Properties of Benzophenone, 2-hydroxy-4-octadecyloxy-

InChI

InChI=1S/C31H46O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-25-34-28-23-24-29(30(32)26-28)31(33)27-21-18-17-19-22-27/h17-19,21-24,26,32H,2-16,20,25H2,1H3

InChI Key

POLSVAXEEHDBMJ-UHFFFAOYSA-N

Formula

C31H46O3

SMILES

CCCCCCCCCCCCCCCCCCOc1ccc(C(=O)c2ccccc2)c(O)c1

Molecular Weight¹

466.71

Other Names

• 2-hydroxy-4-(octadecyloxy)benzophenone

• ω : Acentric Factor.
• 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).
• 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).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Standard Gibbs free energy of formation, Ionization energy 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	[584.36; 1408.50]	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			-5.48630e+01
Coefficient B			2.79492e+00
Coefficient C			-1.78462e-03
Coefficient D			4.53060e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	584.36	J/mol×K	273.00	Calculated Property
Cp,gas	730.62	J/mol×K	353.78	Calculated Property
Cp,gas	859.86	J/mol×K	434.56	Calculated Property
Cp,gas	973.52	J/mol×K	515.33	Calculated Property
Cp,gas	1073.03	J/mol×K	596.11	Calculated Property
Cp,gas	1159.82	J/mol×K	676.89	Calculated Property
Cp,gas	1235.33	J/mol×K	757.67	Calculated Property
Cp,gas	1301.00	J/mol×K	838.44	Calculated Property
Cp,gas	1358.24	J/mol×K	919.22	Calculated Property
Cp,gas	1408.50	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0000127; 0.0000010]	Pa×s	[688.37; 966.89]	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			-2.01763e+01
Coefficient B			6.12604e+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.			688.37
Temperature range, max.			966.89
η	0.0000127	Pa×s	688.37	Calculated Property
η	0.0000086	Pa×s	719.32	Calculated Property
η	0.0000061	Pa×s	750.26	Calculated Property
η	0.0000044	Pa×s	781.21	Calculated Property
η	0.0000033	Pa×s	812.16	Calculated Property
η	0.0000025	Pa×s	843.10	Calculated Property
η	0.0000019	Pa×s	874.05	Calculated Property
η	0.0000015	Pa×s	905.00	Calculated Property
η	0.0000012	Pa×s	935.94	Calculated Property
η	0.0000010	Pa×s	966.89	Calculated Property

Similar Compounds

Find more compounds similar to Benzophenone, 2-hydroxy-4-octadecyloxy-.

Sources

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

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