Chemical Properties of Sarcosine, N-(2-fluorobenzoyl)-, decyl ester

InChI

InChI=1S/C20H30FNO3/c1-3-4-5-6-7-8-9-12-15-25-19(23)16-22(2)20(24)17-13-10-11-14-18(17)21/h10-11,13-14H,3-9,12,15-16H2,1-2H3

InChI Key

GQFJOLDNCFKLEE-UHFFFAOYSA-N

Formula

C20H30FNO3

SMILES

CCCCCCCCCCOC(=O)CN(C)C(=O)c1ccccc1F

Molecular Weight¹

351.46

• 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°	-226.57	kJ/mol	Joback Calculated Property
ΔfH°gas	-717.03	kJ/mol	Joback Calculated Property
ΔfusH°	51.69	kJ/mol	Joback Calculated Property
ΔvapH°	80.18	kJ/mol	Joback Calculated Property
log10WS	-5.41		Crippen Calculated Property
logPoct/wat	4.582		Crippen Calculated Property
McVol	289.660	ml/mol	McGowan Calculated Property
Pc	1312.75	kPa	Joback Calculated Property
Inp	[2572.00; 2572.00]
Inp	2572.00		NIST
Inp	2572.00		NIST
Tboil	830.53	K	Joback Calculated Property
Tc	1025.47	K	Joback Calculated Property
Tfus	509.25	K	Joback Calculated Property
Vc	1.113	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[897.87; 980.04]	J/mol×K	[830.53; 1025.47]
Cp,gas	897.87	J/mol×K	830.53	Joback Calculated Property
Cp,gas	914.05	J/mol×K	863.02	Joback Calculated Property
Cp,gas	929.19	J/mol×K	895.51	Joback Calculated Property
Cp,gas	943.31	J/mol×K	928.00	Joback Calculated Property
Cp,gas	956.47	J/mol×K	960.49	Joback Calculated Property
Cp,gas	968.70	J/mol×K	992.98	Joback Calculated Property
Cp,gas	980.04	J/mol×K	1025.47	Joback Calculated Property

Similar Compounds

Find more compounds similar to Sarcosine, N-(2-fluorobenzoyl)-, decyl ester.

Sources

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

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