Chemical Properties of Sarcosine, N-(cyclopentylcarbonyl)-, pentadecyl ester

InChI

InChI=1S/C24H45NO3/c1-3-4-5-6-7-8-9-10-11-12-13-14-17-20-28-23(26)21-25(2)24(27)22-18-15-16-19-22/h22H,3-21H2,1-2H3

InChI Key

BLWITBKTTXSLRO-UHFFFAOYSA-N

Formula

C24H45NO3

SMILES

CCCCCCCCCCCCCCCOC(=O)CN(C)C(=O)C1CCCC1

Molecular Weight¹

395.62

• 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	1.0739		Relay (1.0) Calculated Property
ΔfG°	-64.31	kJ/mol	Joback Calculated Property
ΔfH°gas	-886.42	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	59.26	kJ/mol	Joback Calculated Property
ΔvapH°	119.68	kJ/mol	Relay (1.0) Calculated Property
IE	8.76	eV	Relay (1.0) Calculated Property
log10WS	-5.96		Relay (1.0) Calculated Property
logPoct/wat	6.269		Crippen Calculated Property
McVol	357.150	ml/mol	McGowan Calculated Property
Pc	955.55	kPa	Joback Calculated Property
Inp	[3080.00; 3080.00]
Inp	3080.00		NIST
Inp	3080.00		NIST
Tboil	656.77	K	Relay (1.0) Calculated Property
Tc	872.73	K	Relay (1.0) Calculated Property
Tfus	324.41	K	Relay (1.0) Calculated Property
Vc	1.352	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1222.82; 1325.11]	J/mol×K	[906.40; 1109.80]
Cp,gas	1222.82	J/mol×K	906.40	Joback Calculated Property
Cp,gas	1243.03	J/mol×K	940.30	Joback Calculated Property
Cp,gas	1261.89	J/mol×K	974.20	Joback Calculated Property
Cp,gas	1279.46	J/mol×K	1008.10	Joback Calculated Property
Cp,gas	1295.81	J/mol×K	1042.00	Joback Calculated Property
Cp,gas	1311.01	J/mol×K	1075.90	Joback Calculated Property
Cp,gas	1325.11	J/mol×K	1109.80	Joback Calculated Property

Similar Compounds

Find more compounds similar to Sarcosine, N-(cyclopentylcarbonyl)-, pentadecyl ester.

Sources

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

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