Chemical Properties of Carbonic acid, monoamide, N-(2-ethylhexyl)-, octyl ester

InChI

InChI=1S/C17H35NO2/c1-4-7-9-10-11-12-14-20-17(19)18-15-16(6-3)13-8-5-2/h16H,4-15H2,1-3H3,(H,18,19)

InChI Key

SDTSBTXASHYMDS-UHFFFAOYSA-N

Formula

C17H35NO2

SMILES

CCCCCCCCOC(=O)NCC(CC)CCCC

Molecular Weight¹

285.47

• 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°	-54.71	kJ/mol	Joback Calculated Property
ΔfH°gas	-590.82	kJ/mol	Joback Calculated Property
ΔfusH°	44.15	kJ/mol	Joback Calculated Property
ΔvapH°	68.64	kJ/mol	Joback Calculated Property
log10WS	-5.73		Crippen Calculated Property
logPoct/wat	5.290		Crippen Calculated Property
McVol	267.810	ml/mol	McGowan Calculated Property
Pc	1291.14	kPa	Joback Calculated Property
Inp	[2037.00; 2037.00]
Inp	2037.00		NIST
Inp	2037.00		NIST
Tboil	714.38	K	Joback Calculated Property
Tc	888.42	K	Joback Calculated Property
Tfus	391.17	K	Joback Calculated Property
Vc	1.040	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[797.36; 894.13]	J/mol×K	[714.38; 888.42]
Cp,gas	797.36	J/mol×K	714.38	Joback Calculated Property
Cp,gas	815.60	J/mol×K	743.39	Joback Calculated Property
Cp,gas	832.96	J/mol×K	772.39	Joback Calculated Property
Cp,gas	849.48	J/mol×K	801.40	Joback Calculated Property
Cp,gas	865.17	J/mol×K	830.40	Joback Calculated Property
Cp,gas	880.04	J/mol×K	859.41	Joback Calculated Property
Cp,gas	894.13	J/mol×K	888.42	Joback Calculated Property

Similar Compounds

Find more compounds similar to Carbonic acid, monoamide, N-(2-ethylhexyl)-, octyl ester.

Sources

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

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