Chemical Properties of Sarcosylsarcosine, n-propoxycarbonyl-,dodecyl ester

InChI

InChI=1S/C22H42N2O5/c1-5-7-8-9-10-11-12-13-14-15-17-28-21(26)19-23(3)20(25)18-24(4)22(27)29-16-6-2/h5-19H2,1-4H3

InChI Key

JSUSYSZGLIWFNJ-UHFFFAOYSA-N

Formula

C22H42N2O5

SMILES

CCCCCCCCCCCCOC(=O)CN(C)C(=O)CN(C)C(=O)OCCC

Molecular Weight¹

414.58

• ω : Acentric Factor.
• 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).
• IE : Ionization energy (eV).
• 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
ω	1.1771		Relay (... Calculated Property
ΔfG°	-240.84	kJ/mol	Joback Calculated Property
ΔfH°gas	-1156.36	kJ/mol	Relay (... Calculated Property
ΔfusH°	65.95	kJ/mol	Joback Calculated Property
ΔvapH°	115.68	kJ/mol	Relay (... Calculated Property
IE	8.64	eV	Relay (... Calculated Property
log10WS	-4.38		Relay (... Calculated Property
logPoct/wat	4.387		Crippen Calculated Property
McVol	357.250	ml/mol	McGowan Calculated Property
Pc	989.51	kPa	Joback Calculated Property
Inp	[2885.00; 2885.00]
Inp	2885.00		NIST
Inp	2885.00		NIST
Tboil	646.51	K	Relay (... Calculated Property
Tc	842.67	K	Relay (... Calculated Property
Tfus	303.86	K	Relay (... Calculated Property
Vc	1.369	m3/kmol	Relay (... Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1201.86; 1289.87]	J/mol×K	[934.09; 1145.70]
Cp,gas	1201.86	J/mol×K	934.09	Joback Calculated Property
Cp,gas	1219.91	J/mol×K	969.36	Joback Calculated Property
Cp,gas	1236.55	J/mol×K	1004.63	Joback Calculated Property
Cp,gas	1251.81	J/mol×K	1039.89	Joback Calculated Property
Cp,gas	1265.75	J/mol×K	1075.16	Joback Calculated Property
Cp,gas	1278.42	J/mol×K	1110.43	Joback Calculated Property
Cp,gas	1289.87	J/mol×K	1145.70	Joback Calculated Property

Similar Compounds

Find more compounds similar to Sarcosylsarcosine, n-propoxycarbonyl-,dodecyl ester.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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