Chemical Properties of Glycine, 2-cyclohexyl-N-isobutoxycarbonyl-, isobutyl ester

InChI

InChI=1S/C17H31NO4/c1-12(2)10-21-16(19)15(14-8-6-5-7-9-14)18-17(20)22-11-13(3)4/h12-15H,5-11H2,1-4H3,(H,18,20)

InChI Key

GAZQZONUKNXMQG-UHFFFAOYSA-N

Formula

C17H31NO4

SMILES

CC(C)COC(=O)C(N=C(O)OCC(C)C)C1CCCCC1

Molecular Weight¹

313.43

• 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	-812.55	kJ/mol	Joback Calculated Property
ΔvapH°	84.34	kJ/mol	Joback Calculated Property
log10WS	-3.65		Crippen Calculated Property
logPoct/wat	3.721		Crippen Calculated Property
McVol	264.390	ml/mol	McGowan Calculated Property
Pc	1479.29	kPa	Joback Calculated Property
Inp	[2035.00; 2035.00]
Inp	2035.00		NIST
Inp	2035.00		NIST
Tboil	874.04	K	Joback Calculated Property
Tc	1081.77	K	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glycine, 2-cyclohexyl-N-isobutoxycarbonyl-, isobutyl ester.

Sources

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

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