Chemical Properties of Glycine, 2-cyclohexyl-N-(but-2-yn-1-yl)oxycarbonyl-, nonyl ester

InChI

InChI=1S/C22H37NO4/c1-3-5-7-8-9-10-14-18-26-21(24)20(19-15-12-11-13-16-19)23-22(25)27-17-6-4-2/h19-20H,3,5,7-18H2,1-2H3,(H,23,25)

InChI Key

DRXGWLHITKPBJU-UHFFFAOYSA-N

Formula

C22H37NO4

SMILES

CC#CCOC(O)=NC(C(=O)OCCCCCCCCC)C1CCCCC1

Molecular Weight¹

379.53

• 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	-632.89	kJ/mol	Joback Calculated Property
ΔvapH°	98.40	kJ/mol	Joback Calculated Property
log10WS	-6.02		Crippen Calculated Property
logPoct/wat	5.183		Crippen Calculated Property
McVol	326.240	ml/mol	McGowan Calculated Property
Pc	1160.08	kPa	Joback Calculated Property
Inp	[2691.00; 2691.00]
Inp	2691.00		NIST
Inp	2691.00		NIST
Tboil	998.32	K	Joback Calculated Property
Tc	1222.75	K	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glycine, 2-cyclohexyl-N-(but-2-yn-1-yl)oxycarbonyl-, nonyl ester.

Sources

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

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