Chemical Properties of Sarcosine, N-(2-methylbenzoyl)-, dodecyl ester

InChI

InChI=1S/C23H37NO3/c1-4-5-6-7-8-9-10-11-12-15-18-27-22(25)19-24(3)23(26)21-17-14-13-16-20(21)2/h13-14,16-17H,4-12,15,18-19H2,1-3H3

InChI Key

MOUWNRCTRCLAMT-UHFFFAOYSA-N

Formula

C23H37NO3

SMILES

CCCCCCCCCCCCOC(=O)CN(C)C(=O)c1ccccc1C

Molecular Weight¹

375.54

• 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°	-6.50	kJ/mol	Joback Calculated Property
ΔfH°gas	-582.84	kJ/mol	Joback Calculated Property
ΔfusH°	56.38	kJ/mol	Joback Calculated Property
ΔvapH°	87.67	kJ/mol	Joback Calculated Property
log10WS	-6.40		Crippen Calculated Property
logPoct/wat	5.531		Crippen Calculated Property
McVol	330.160	ml/mol	McGowan Calculated Property
Pc	1108.89	kPa	Joback Calculated Property
Inp	[2885.00; 2885.00]
Inp	2885.00		NIST
Inp	2885.00		NIST
Tboil	899.90	K	Joback Calculated Property
Tc	1104.15	K	Joback Calculated Property
Tfus	542.47	K	Joback Calculated Property
Vc	1.264	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1071.26; 1158.47]	J/mol×K	[899.90; 1104.15]
Cp,gas	1071.26	J/mol×K	899.90	Joback Calculated Property
Cp,gas	1088.62	J/mol×K	933.94	Joback Calculated Property
Cp,gas	1104.77	J/mol×K	967.98	Joback Calculated Property
Cp,gas	1119.78	J/mol×K	1002.02	Joback Calculated Property
Cp,gas	1133.70	J/mol×K	1036.07	Joback Calculated Property
Cp,gas	1146.58	J/mol×K	1070.11	Joback Calculated Property
Cp,gas	1158.47	J/mol×K	1104.15	Joback Calculated Property

Similar Compounds

Find more compounds similar to Sarcosine, N-(2-methylbenzoyl)-, dodecyl ester.

Sources

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

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