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

InChI

InChI=1S/C22H35NO3/c1-4-5-6-7-8-9-10-11-14-17-26-21(24)18-23(3)22(25)20-16-13-12-15-19(20)2/h12-13,15-16H,4-11,14,17-18H2,1-3H3

InChI Key

BJNSYMPTAIZPKV-UHFFFAOYSA-N

Formula

C22H35NO3

SMILES

CCCCCCCCCCCOC(=O)CN(C)C(=O)c1ccccc1C

Molecular Weight¹

361.52

• 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°	-14.92	kJ/mol	Joback Calculated Property
ΔfH°gas	-562.20	kJ/mol	Joback Calculated Property
ΔfusH°	53.79	kJ/mol	Joback Calculated Property
ΔvapH°	85.45	kJ/mol	Joback Calculated Property
log10WS	-5.98		Crippen Calculated Property
logPoct/wat	5.141		Crippen Calculated Property
McVol	316.070	ml/mol	McGowan Calculated Property
Pc	1183.34	kPa	Joback Calculated Property
Inp	[2756.00; 2756.00]
Inp	2756.00		NIST
Inp	2756.00		NIST
Tboil	877.02	K	Joback Calculated Property
Tc	1078.66	K	Joback Calculated Property
Tfus	531.20	K	Joback Calculated Property
Vc	1.208	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1010.30; 1096.45]	J/mol×K	[877.02; 1078.66]
Cp,gas	1010.30	J/mol×K	877.02	Joback Calculated Property
Cp,gas	1027.39	J/mol×K	910.63	Joback Calculated Property
Cp,gas	1043.32	J/mol×K	944.23	Joback Calculated Property
Cp,gas	1058.14	J/mol×K	977.84	Joback Calculated Property
Cp,gas	1071.90	J/mol×K	1011.45	Joback Calculated Property
Cp,gas	1084.66	J/mol×K	1045.06	Joback Calculated Property
Cp,gas	1096.45	J/mol×K	1078.66	Joback Calculated Property

Similar Compounds

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

Sources

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

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.