Chemical Properties of Sarcosine, N-cyclopropylcarbonyl-, butyl ester

InChI

InChI=1S/C11H19NO3/c1-3-4-7-15-10(13)8-12(2)11(14)9-5-6-9/h9H,3-8H2,1-2H3

InChI Key

WQTOMRSEBYPBMK-UHFFFAOYSA-N

Formula

C11H19NO3

SMILES

CCCCOC(=O)CN(C)C(=O)C1CC1

Molecular Weight¹

213.27

• 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	0.6602		Relay (1.0) Calculated Property
ΔfG°	-149.57	kJ/mol	Joback Calculated Property
ΔfH°gas	-594.34	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	29.79	kJ/mol	Joback Calculated Property
ΔvapH°	72.54	kJ/mol	Relay (1.0) Calculated Property
IE	8.61	eV	Relay (1.0) Calculated Property
log10WS	-1.36		Relay (1.0) Calculated Property
logPoct/wat	1.198		Crippen Calculated Property
McVol	173.980	ml/mol	McGowan Calculated Property
Pc	2410.00	kPa	Joback Calculated Property
Inp	[1650.00; 1650.00]
Inp	1650.00		NIST
Inp	1650.00		NIST
Tboil	543.86	K	Relay (1.0) Calculated Property
Tc	740.91	K	Relay (1.0) Calculated Property
Tfus	276.34	K	Relay (1.0) Calculated Property
Vc	0.665	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[461.44; 540.22]	J/mol×K	[600.42; 789.27]
Cp,gas	461.44	J/mol×K	600.42	Joback Calculated Property
Cp,gas	476.50	J/mol×K	631.89	Joback Calculated Property
Cp,gas	490.73	J/mol×K	663.37	Joback Calculated Property
Cp,gas	504.19	J/mol×K	694.84	Joback Calculated Property
Cp,gas	516.90	J/mol×K	726.32	Joback Calculated Property
Cp,gas	528.89	J/mol×K	757.79	Joback Calculated Property
Cp,gas	540.22	J/mol×K	789.27	Joback Calculated Property

Similar Compounds

Find more compounds similar to Sarcosine, N-cyclopropylcarbonyl-, butyl ester.

Sources

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

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