Chemical Properties of DIMETHYL 5,6-ACENAPHTHENEDICARBOXYLATE

InChI

InChI=1S/C16H14O4/c1-19-15(17)11-7-5-9-3-4-10-6-8-12(16(18)20-2)14(11)13(9)10/h5-8H,3-4H2,1-2H3

InChI Key

KZDDQWFGWDKABI-UHFFFAOYSA-N

Formula

C16H14O4

SMILES

COC(=O)c1ccc2c3c(ccc(C(=O)OC)c13)CC2

Molecular Weight¹

270.28

Other Names

• 5,6-Dicarbomethoxyacenaphthene

• 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_fusH : Enthalpy of fusion at a given temperature (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, Enthalpy of vaporization at standard conditions, 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.

Temperature Dependent Properties

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[268.71; 610.83]	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			-2.00500e+01
Coefficient B			1.28064e+00
Coefficient C			-8.79160e-04
Coefficient D			2.29400e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	268.71	J/mol×K	273.00	Calculated Property
Cp,gas	333.13	J/mol×K	353.78	Calculated Property
Cp,gas	389.26	J/mol×K	434.56	Calculated Property
Cp,gas	437.82	J/mol×K	515.33	Calculated Property
Cp,gas	479.54	J/mol×K	596.11	Calculated Property
Cp,gas	515.13	J/mol×K	676.89	Calculated Property
Cp,gas	545.34	J/mol×K	757.67	Calculated Property
Cp,gas	570.87	J/mol×K	838.44	Calculated Property
Cp,gas	592.46	J/mol×K	919.22	Calculated Property
Cp,gas	610.83	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0014396; 0.0005473]	Pa×s	[489.64; 687.44]	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			-9.90453e+00
Coefficient B			1.64574e+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.			489.64
Temperature range, max.			687.44
η	0.0014396	Pa×s	489.64	Calculated Property
η	0.0012460	Pa×s	511.62	Calculated Property
η	0.0010914	Pa×s	533.60	Calculated Property
η	0.0009660	Pa×s	555.57	Calculated Property
η	0.0008631	Pa×s	577.55	Calculated Property
η	0.0007775	Pa×s	599.53	Calculated Property
η	0.0007055	Pa×s	621.51	Calculated Property
η	0.0006445	Pa×s	643.49	Calculated Property
η	0.0005923	Pa×s	665.47	Calculated Property
η	0.0005473	Pa×s	687.44	Calculated Property

Similar Compounds

Find more compounds similar to DIMETHYL 5,6-ACENAPHTHENEDICARBOXYLATE.

Sources

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

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