Chemical Properties of Fumaric acid, monoamide, N,N-dimethyl-, 2-naphthyl ester

InChI

InChI=1S/C16H15NO3/c1-17(2)15(18)9-10-16(19)20-14-8-7-12-5-3-4-6-13(12)11-14/h3-11H,1-2H3/b10-9+

InChI Key

BYLYCUBVNBFWBF-MDZDMXLPSA-N

Formula

C16H15NO3

SMILES

CN(C)C(=O)C=CC(=O)Oc1ccc2ccccc2c1

Molecular Weight¹

269.30

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• 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).
• 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).
• I_np : Non-polar retention indices.
• 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

Property	Value	Unit	Source
ΔfG°	121.43	kJ/mol	Joback Calculated Property
ΔfH°gas	-130.07	kJ/mol	Joback Calculated Property
ΔfusH°	35.48	kJ/mol	Joback Calculated Property
ΔvapH°	73.69	kJ/mol	Joback Calculated Property
log10WS	-3.46		Crippen Calculated Property
logPoct/wat	2.390		Crippen Calculated Property
McVol	207.770	ml/mol	McGowan Calculated Property
Pc	2417.12	kPa	Joback Calculated Property
Inp	[2679.00; 2679.00]
Inp	2679.00		NIST
Inp	2679.00		NIST
Tboil	762.88	K	Joback Calculated Property
Tc	991.96	K	Joback Calculated Property
Tfus	491.20	K	Joback Calculated Property
Vc	0.773	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[567.36; 634.53]	J/mol×K	[762.88; 991.96]
Cp,gas	567.36	J/mol×K	762.88	Joback Calculated Property
Cp,gas	580.73	J/mol×K	801.06	Joback Calculated Property
Cp,gas	593.10	J/mol×K	839.24	Joback Calculated Property
Cp,gas	604.58	J/mol×K	877.42	Joback Calculated Property
Cp,gas	615.25	J/mol×K	915.60	Joback Calculated Property
Cp,gas	625.20	J/mol×K	953.78	Joback Calculated Property
Cp,gas	634.53	J/mol×K	991.96	Joback Calculated Property

Similar Compounds

Find more compounds similar to Fumaric acid, monoamide, N,N-dimethyl-, 2-naphthyl ester.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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