Chemical Properties of Carbonic acid, monoamide, N-isobutyl-, hexyl ester

InChI

InChI=1S/C11H23NO2/c1-4-5-6-7-8-14-11(13)12-9-10(2)3/h10H,4-9H2,1-3H3,(H,12,13)

InChI Key

IZWHBMNOJYZVSK-UHFFFAOYSA-N

Formula

C11H23NO2

SMILES

CCCCCCOC(=O)NCC(C)C

Molecular Weight¹

201.31

• ω : Acentric Factor.
• 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).
• 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).
• 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
ω	0.6947		Relay (1.0) Calculated Property
ΔfG°	-105.23	kJ/mol	Joback Calculated Property
ΔfH°gas	-608.66	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	28.61	kJ/mol	Joback Calculated Property
ΔvapH°	68.60	kJ/mol	Relay (1.0) Calculated Property
IE	9.15	eV	Relay (1.0) Calculated Property
log10WS	-3.41		Relay (1.0) Calculated Property
logPoct/wat	2.949		Crippen Calculated Property
McVol	183.270	ml/mol	McGowan Calculated Property
Pc	2053.03	kPa	Joback Calculated Property
Inp	[1478.00; 1478.00]
Inp	1478.00		NIST
Inp	1478.00		NIST
Tboil	516.56	K	Relay (1.0) Calculated Property
Tc	695.42	K	Relay (1.0) Calculated Property
Tfus	247.88	K	Relay (1.0) Calculated Property
Vc	0.691	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[470.14; 552.57]	J/mol×K	[577.10; 753.70]
Cp,gas	470.14	J/mol×K	577.10	Joback Calculated Property
Cp,gas	485.47	J/mol×K	606.53	Joback Calculated Property
Cp,gas	500.16	J/mol×K	635.97	Joback Calculated Property
Cp,gas	514.20	J/mol×K	665.40	Joback Calculated Property
Cp,gas	527.61	J/mol×K	694.84	Joback Calculated Property
Cp,gas	540.39	J/mol×K	724.27	Joback Calculated Property
Cp,gas	552.57	J/mol×K	753.70	Joback Calculated Property

Similar Compounds

Find more compounds similar to Carbonic acid, monoamide, N-isobutyl-, hexyl ester.

Sources

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

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