Chemical Properties of Glycine, 2-cyclohexyl-N-(3-chloropropoxycarbonyl)-, decyl ester

InChI

InChI=1S/C22H40ClNO4/c1-2-3-4-5-6-7-8-12-17-27-21(25)20(19-14-10-9-11-15-19)24-22(26)28-18-13-16-23/h19-20H,2-18H2,1H3,(H,24,26)

InChI Key

CQAYYOPJBYKRMB-UHFFFAOYSA-N

Formula

C22H40ClNO4

SMILES

CCCCCCCCCCOC(=O)C(NC(=O)OCCCCl)C1CCCCC1

Molecular Weight¹

418.01

• 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°	-234.01	kJ/mol	Joback Calculated Property
ΔfH°gas	-900.24	kJ/mol	Joback Calculated Property
ΔfusH°	55.92	kJ/mol	Joback Calculated Property
ΔvapH°	93.74	kJ/mol	Joback Calculated Property
log10WS	-6.84		Crippen Calculated Property
logPoct/wat	5.974		Crippen Calculated Property
McVol	347.080	ml/mol	McGowan Calculated Property
Pc	1075.69	kPa	Joback Calculated Property
Inp	[2867.00; 2867.00]
Inp	2867.00		NIST
Inp	2867.00		NIST
Tboil	962.05	K	Joback Calculated Property
Tc	1178.08	K	Joback Calculated Property
Tfus	556.98	K	Joback Calculated Property
Vc	1.327	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1182.43; 1260.54]	J/mol×K	[962.05; 1178.08]
Cp,gas	1182.43	J/mol×K	962.05	Joback Calculated Property
Cp,gas	1199.28	J/mol×K	998.05	Joback Calculated Property
Cp,gas	1214.54	J/mol×K	1034.06	Joback Calculated Property
Cp,gas	1228.25	J/mol×K	1070.06	Joback Calculated Property
Cp,gas	1240.46	J/mol×K	1106.07	Joback Calculated Property
Cp,gas	1251.21	J/mol×K	1142.07	Joback Calculated Property
Cp,gas	1260.54	J/mol×K	1178.08	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glycine, 2-cyclohexyl-N-(3-chloropropoxycarbonyl)-, decyl ester.

Sources

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

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