Chemical Properties of 4,4'-DIMETHYLBENZOIC ANHYDRIDE

InChI

InChI=1S/C16H14O3/c1-11-3-7-13(8-4-11)15(17)19-16(18)14-9-5-12(2)6-10-14/h3-10H,1-2H3

InChI Key

BJMLLSSSTGHJJE-UHFFFAOYSA-N

Formula

C16H14O3

SMILES

Cc1ccc(C(=O)OC(=O)c2ccc(C)cc2)cc1

Molecular Weight¹

254.29

• ω : Acentric Factor.
• Δ_cH°_solid : Standard solid enthalpy of combustion (kJ/mol).
• 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_fH°_solid : Solid phase 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	[252.75; 598.78]	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			-1.81000e+01
Coefficient B			1.16424e+00
Coefficient C			-6.61620e-04
Coefficient D			1.14260e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	252.75	J/mol×K	273.00	Calculated Property
Cp,gas	316.03	J/mol×K	353.78	Calculated Property
Cp,gas	372.26	J/mol×K	434.56	Calculated Property
Cp,gas	421.80	J/mol×K	515.33	Calculated Property
Cp,gas	465.01	J/mol×K	596.11	Calculated Property
Cp,gas	502.26	J/mol×K	676.89	Calculated Property
Cp,gas	533.89	J/mol×K	757.67	Calculated Property
Cp,gas	560.29	J/mol×K	838.44	Calculated Property
Cp,gas	581.79	J/mol×K	919.22	Calculated Property
Cp,gas	598.78	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0010133; 0.0001419]	Pa×s	[440.22; 685.66]	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			-1.23855e+01
Coefficient B			2.41723e+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.			440.22
Temperature range, max.			685.66
η	0.0010133	Pa×s	440.22	Calculated Property
η	0.0007355	Pa×s	467.49	Calculated Property
η	0.0005531	Pa×s	494.76	Calculated Property
η	0.0004285	Pa×s	522.03	Calculated Property
η	0.0003405	Pa×s	549.31	Calculated Property
η	0.0002765	Pa×s	576.58	Calculated Property
η	0.0002288	Pa×s	603.85	Calculated Property
η	0.0001925	Pa×s	631.12	Calculated Property
η	0.0001642	Pa×s	658.39	Calculated Property
η	0.0001419	Pa×s	685.66	Calculated Property

Similar Compounds

Find more compounds similar to 4,4'-DIMETHYLBENZOIC ANHYDRIDE.

Sources

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

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