Chemical Properties of Carbonic acid, monoamide, N-dodecyl-, octyl ester

InChI

InChI=1S/C21H43NO2/c1-3-5-7-9-11-12-13-14-15-17-19-22-21(23)24-20-18-16-10-8-6-4-2/h3-20H2,1-2H3,(H,22,23)

InChI Key

WNSSHFYWVJLCIE-UHFFFAOYSA-N

Formula

C21H43NO2

SMILES

CCCCCCCCCCCCN=C(O)OCCCCCCCC

Molecular Weight¹

341.57

• Δ_fH°_gas : Enthalpy of formation 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).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfH°gas	-688.79	kJ/mol	Joback Calculated Property
ΔvapH°	84.82	kJ/mol	Joback Calculated Property
log10WS	-7.18		Crippen Calculated Property
logPoct/wat	7.198		Crippen Calculated Property
McVol	324.170	ml/mol	McGowan Calculated Property
Pc	941.52	kPa	Joback Calculated Property
Inp	[2528.00; 2528.00]
Inp	2528.00		NIST
Inp	2528.00		NIST
Tboil	871.04	K	Joback Calculated Property
Tc	1066.65	K	Joback Calculated Property

Similar Compounds

Find more compounds similar to Carbonic acid, monoamide, N-dodecyl-, octyl ester.

Sources

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

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