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

InChI

InChI=1S/C14H25NO3/c1-5-7-8-12(6-2)11-18-14(17)10-9-13(16)15(3)4/h9-10,12H,5-8,11H2,1-4H3/b10-9+

InChI Key

PMOFUGINNHITNZ-MDZDMXLPSA-N

Formula

C14H25NO3

SMILES

CCCCC(CC)COC(=O)C=CC(=O)N(C)C

Molecular Weight¹

255.35

• 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°	-107.28	kJ/mol	Joback Calculated Property
ΔfH°gas	-510.20	kJ/mol	Joback Calculated Property
ΔfusH°	36.10	kJ/mol	Joback Calculated Property
ΔvapH°	64.27	kJ/mol	Joback Calculated Property
log10WS	-2.50		Crippen Calculated Property
logPoct/wat	2.390		Crippen Calculated Property
McVol	222.810	ml/mol	McGowan Calculated Property
Pc	1743.37	kPa	Joback Calculated Property
Inp	[2062.00; 2062.00]
Inp	2062.00		NIST
Inp	2062.00		NIST
Tboil	666.04	K	Joback Calculated Property
Tc	848.98	K	Joback Calculated Property
Tfus	382.02	K	Joback Calculated Property
Vc	0.842	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[611.90; 695.64]	J/mol×K	[666.04; 848.98]
Cp,gas	611.90	J/mol×K	666.04	Joback Calculated Property
Cp,gas	627.81	J/mol×K	696.53	Joback Calculated Property
Cp,gas	642.90	J/mol×K	727.02	Joback Calculated Property
Cp,gas	657.20	J/mol×K	757.51	Joback Calculated Property
Cp,gas	670.74	J/mol×K	788.00	Joback Calculated Property
Cp,gas	683.54	J/mol×K	818.49	Joback Calculated Property
Cp,gas	695.64	J/mol×K	848.98	Joback Calculated Property

Similar Compounds

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

Sources

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

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