Chemical Properties of Methacrylglycine, methyl ester

InChI

InChI=1S/C8H13NO3/c1-6(2)4-7(10)9-5-8(11)12-3/h1,4-5H2,2-3H3,(H,9,10)

InChI Key

TZSHCLFMEXZCRJ-UHFFFAOYSA-N

Formula

C8H13NO3

SMILES

C=C(C)CC(=O)NCC(=O)OC

Molecular Weight¹

171.19

• 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	0.5550		Relay (1.0) Calculated Property
ΔfG°	-177.68	kJ/mol	Joback Calculated Property
ΔfH°gas	-526.02	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	23.37	kJ/mol	Joback Calculated Property
ΔvapH°	69.01	kJ/mol	Relay (1.0) Calculated Property
IE	9.25	eV	Relay (1.0) Calculated Property
log10WS	-0.92		Relay (1.0) Calculated Property
logPoct/wat	0.242		Crippen Calculated Property
McVol	138.270	ml/mol	McGowan Calculated Property
Pc	3028.94	kPa	Joback Calculated Property
Inp	[1226.00; 1226.00]
Inp	1226.00		NIST
Inp	1226.00		NIST
Tboil	508.52	K	Relay (1.0) Calculated Property
Tc	696.86	K	Relay (1.0) Calculated Property
Tfus	295.12	K	Relay (1.0) Calculated Property
Vc	0.493	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[325.66; 385.94]	J/mol×K	[559.33; 752.54]
Cp,gas	325.66	J/mol×K	559.33	Joback Calculated Property
Cp,gas	337.05	J/mol×K	591.53	Joback Calculated Property
Cp,gas	347.89	J/mol×K	623.73	Joback Calculated Property
Cp,gas	358.19	J/mol×K	655.93	Joback Calculated Property
Cp,gas	367.96	J/mol×K	688.14	Joback Calculated Property
Cp,gas	377.21	J/mol×K	720.34	Joback Calculated Property
Cp,gas	385.94	J/mol×K	752.54	Joback Calculated Property

Similar Compounds

Find more compounds similar to Methacrylglycine, methyl ester.

Sources

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

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