Chemical Properties of Fumaric acid, monoamide, N,N-dimethyl-, 4-isopropoxyphenyl ester

InChI

InChI=1S/C15H19NO4/c1-11(2)19-12-5-7-13(8-6-12)20-15(18)10-9-14(17)16(3)4/h5-11H,1-4H3/b10-9+

InChI Key

GSBUVGNPDVPIMO-MDZDMXLPSA-N

Formula

C15H19NO4

SMILES

CC(C)Oc1ccc(OC(=O)C=CC(=O)N(C)C)cc1

Molecular Weight¹

277.32

• 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°	-101.08	kJ/mol	Joback Calculated Property
ΔfH°gas	-438.00	kJ/mol	Joback Calculated Property
ΔfusH°	33.53	kJ/mol	Joback Calculated Property
ΔvapH°	71.85	kJ/mol	Joback Calculated Property
log10WS	-2.73		Crippen Calculated Property
logPoct/wat	2.024		Crippen Calculated Property
McVol	219.010	ml/mol	McGowan Calculated Property
Pc	2081.22	kPa	Joback Calculated Property
Inp	[2266.00; 2266.00]
Inp	2266.00		NIST
Inp	2266.00		NIST
Tboil	743.00	K	Joback Calculated Property
Tc	954.53	K	Joback Calculated Property
Tfus	454.46	K	Joback Calculated Property
Vc	0.807	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[609.95; 683.14]	J/mol×K	[743.00; 954.53]
Cp,gas	609.95	J/mol×K	743.00	Joback Calculated Property
Cp,gas	624.56	J/mol×K	778.26	Joback Calculated Property
Cp,gas	638.17	J/mol×K	813.51	Joback Calculated Property
Cp,gas	650.79	J/mol×K	848.77	Joback Calculated Property
Cp,gas	662.47	J/mol×K	884.02	Joback Calculated Property
Cp,gas	673.24	J/mol×K	919.28	Joback Calculated Property
Cp,gas	683.14	J/mol×K	954.53	Joback Calculated Property

Similar Compounds

Find more compounds similar to Fumaric acid, monoamide, N,N-dimethyl-, 4-isopropoxyphenyl ester.

Sources

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

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