Chemical Properties of Glycine, 2-cyclohexyl-N-benzyloxycarbonyl-, pentyl ester

InChI

InChI=1S/C21H31NO4/c1-2-3-10-15-25-20(23)19(18-13-8-5-9-14-18)22-21(24)26-16-17-11-6-4-7-12-17/h4,6-7,11-12,18-19H,2-3,5,8-10,13-16H2,1H3,(H,22,24)

InChI Key

DCLMTGLPLXDJBD-UHFFFAOYSA-N

Formula

C21H31NO4

SMILES

CCCCCOC(=O)C(N=C(O)OCc1ccccc1)C1CCCCC1

Molecular Weight¹

361.48

• 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	-648.02	kJ/mol	Joback Calculated Property
ΔvapH°	96.30	kJ/mol	Joback Calculated Property
log10WS	-5.40		Crippen Calculated Property
logPoct/wat	4.800		Crippen Calculated Property
McVol	296.990	ml/mol	McGowan Calculated Property
Pc	1403.79	kPa	Joback Calculated Property
Inp	[2645.00; 2645.00]
Inp	2645.00		NIST
Inp	2645.00		NIST
Tboil	993.12	K	Joback Calculated Property
Tc	1220.73	K	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glycine, 2-cyclohexyl-N-benzyloxycarbonyl-, pentyl ester.

Sources

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

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