Chemical Properties of Sarcosine, N-(3-cyclopentylpropionyl)-, heptyl ester

InChI

InChI=1S/C18H33NO3/c1-3-4-5-6-9-14-22-18(21)15-19(2)17(20)13-12-16-10-7-8-11-16/h16H,3-15H2,1-2H3

InChI Key

AWBRZDIJHAIONR-UHFFFAOYSA-N

Formula

C18H33NO3

SMILES

CCCCCCCOC(=O)CN(C)C(=O)CCC1CCCC1

Molecular Weight¹

311.46

• 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°	-114.83	kJ/mol	Joback Calculated Property
ΔfH°gas	-644.22	kJ/mol	Joback Calculated Property
ΔfusH°	43.72	kJ/mol	Joback Calculated Property
ΔvapH°	73.86	kJ/mol	Joback Calculated Property
log10WS	-4.22		Crippen Calculated Property
logPoct/wat	3.929		Crippen Calculated Property
McVol	272.610	ml/mol	McGowan Calculated Property
Pc	1414.37	kPa	Joback Calculated Property
Inp	[2377.00; 2377.00]
Inp	2377.00		NIST
Inp	2377.00		NIST
Tboil	769.12	K	Joback Calculated Property
Tc	959.18	K	Joback Calculated Property
Tfus	458.08	K	Joback Calculated Property
Vc	1.032	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[853.47; 949.71]	J/mol×K	[769.12; 959.18]
Cp,gas	853.47	J/mol×K	769.12	Joback Calculated Property
Cp,gas	872.13	J/mol×K	800.80	Joback Calculated Property
Cp,gas	889.69	J/mol×K	832.47	Joback Calculated Property
Cp,gas	906.19	J/mol×K	864.15	Joback Calculated Property
Cp,gas	921.67	J/mol×K	895.83	Joback Calculated Property
Cp,gas	936.16	J/mol×K	927.51	Joback Calculated Property
Cp,gas	949.71	J/mol×K	959.18	Joback Calculated Property

Similar Compounds

Find more compounds similar to Sarcosine, N-(3-cyclopentylpropionyl)-, heptyl ester.

Sources

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

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