Chemical Properties of Sarcosine, N-(1-naphthoyl)-, propyl ester

InChI

InChI=1S/C17H19NO3/c1-3-11-21-16(19)12-18(2)17(20)15-10-6-8-13-7-4-5-9-14(13)15/h4-10H,3,11-12H2,1-2H3

InChI Key

KPFUTBYCLGRDIM-UHFFFAOYSA-N

Formula

C17H19NO3

SMILES

CCCOC(=O)CN(C)C(=O)c1cccc2ccccc12

Molecular Weight¹

285.34

• 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°	49.63	kJ/mol	Joback Calculated Property
ΔfH°gas	-267.93	kJ/mol	Joback Calculated Property
ΔfusH°	37.86	kJ/mol	Joback Calculated Property
ΔvapH°	75.96	kJ/mol	Joback Calculated Property
log10WS	-3.96		Crippen Calculated Property
logPoct/wat	2.865		Crippen Calculated Property
McVol	226.160	ml/mol	McGowan Calculated Property
Pc	2100.34	kPa	Joback Calculated Property
Inp	[2419.00; 2419.00]
Inp	2419.00		NIST
Inp	2419.00		NIST
Tboil	781.60	K	Joback Calculated Property
Tc	999.98	K	Joback Calculated Property
Tfus	507.55	K	Joback Calculated Property
Vc	0.850	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[646.94; 718.59]	J/mol×K	[781.60; 999.98]
Cp,gas	646.94	J/mol×K	781.60	Joback Calculated Property
Cp,gas	661.20	J/mol×K	818.00	Joback Calculated Property
Cp,gas	674.43	J/mol×K	854.39	Joback Calculated Property
Cp,gas	686.72	J/mol×K	890.79	Joback Calculated Property
Cp,gas	698.13	J/mol×K	927.19	Joback Calculated Property
Cp,gas	708.73	J/mol×K	963.59	Joback Calculated Property
Cp,gas	718.59	J/mol×K	999.98	Joback Calculated Property

Similar Compounds

Find more compounds similar to Sarcosine, N-(1-naphthoyl)-, propyl ester.

Sources

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

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