Chemical Properties of 1,3-Di-(2,4-dimethyl-benzoyl)-propane

InChI

InChI=1S/C21H24O2/c1-14-8-10-18(16(3)12-14)20(22)6-5-7-21(23)19-11-9-15(2)13-17(19)4/h8-13H,5-7H2,1-4H3

InChI Key

GWLPWMUYNCDPJK-UHFFFAOYSA-N

Formula

C21H24O2

SMILES

Cc1ccc(C(=O)CCCC(=O)c2ccc(C)cc2C)c(C)c1

Molecular Weight¹

308.42

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• 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).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[348.51; 831.56]	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			-1.20970e+01
Coefficient B			1.54708e+00
Coefficient C			-8.75440e-04
Coefficient D			1.72020e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	348.51	J/mol×K	273.00	Calculated Property
Cp,gas	433.27	J/mol×K	353.78	Calculated Property
Cp,gas	508.99	J/mol×K	434.56	Calculated Property
Cp,gas	576.22	J/mol×K	515.33	Calculated Property
Cp,gas	635.49	J/mol×K	596.11	Calculated Property
Cp,gas	687.35	J/mol×K	676.89	Calculated Property
Cp,gas	732.34	J/mol×K	757.67	Calculated Property
Cp,gas	771.01	J/mol×K	838.44	Calculated Property
Cp,gas	803.90	J/mol×K	919.22	Calculated Property
Cp,gas	831.56	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0006166; 0.0001346]	Pa×s	[529.21; 761.35]	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			-1.23835e+01
Coefficient B			2.64198e+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.			529.21
Temperature range, max.			761.35
η	0.0006166	Pa×s	529.21	Calculated Property
η	0.0004890	Pa×s	555.00	Calculated Property
η	0.0003958	Pa×s	580.80	Calculated Property
η	0.0003262	Pa×s	606.59	Calculated Property
η	0.0002731	Pa×s	632.38	Calculated Property
η	0.0002318	Pa×s	658.17	Calculated Property
η	0.0001993	Pa×s	683.97	Calculated Property
η	0.0001732	Pa×s	709.76	Calculated Property
η	0.0001520	Pa×s	735.55	Calculated Property
η	0.0001346	Pa×s	761.35	Calculated Property

Similar Compounds

Find more compounds similar to 1,3-Di-(2,4-dimethyl-benzoyl)-propane.

Sources

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

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