Chemical Properties of N,N-dimethylphenylglycine

InChI

InChI=1S/C10H13NO2/c1-11(2)9(10(12)13)8-6-4-3-5-7-8/h3-7,9H,1-2H3,(H,12,13)

InChI Key

MLOBRLOZPSSKKO-UHFFFAOYSA-N

Formula

C10H13NO2

SMILES

CN(C)C(C(=O)O)c1ccccc1

Molecular Weight¹

179.22

• 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 : 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	0.6292		Relay (1.0) Calculated Property
ΔfG°	-11.67	kJ/mol	Joback Calculated Property
ΔfH°gas	-267.32	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	20.88	kJ/mol	Joback Calculated Property
ΔvapH°	63.05	kJ/mol	Relay (1.0) Calculated Property
IE	7.86	eV	Relay (1.0) Calculated Property
log10WS	-0.52		Relay (1.0) Calculated Property
logPoct/wat	1.374		Crippen Calculated Property
McVol	145.420	ml/mol	McGowan Calculated Property
Pc	3517.91	kPa	Joback Calculated Property
I	[2037.00; 2037.00]
I	2037.00		NIST
I	2037.00		NIST
Tboil	544.18	K	Relay (1.0) Calculated Property
Tc	777.42	K	Relay (1.0) Calculated Property
Tfus	427.92	K	Relay (1.0) Calculated Property
Vc	0.502	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[364.00; 425.41]	J/mol×K	[612.93; 814.53]
Cp,gas	364.00	J/mol×K	612.93	Joback Calculated Property
Cp,gas	376.06	J/mol×K	646.53	Joback Calculated Property
Cp,gas	387.35	J/mol×K	680.13	Joback Calculated Property
Cp,gas	397.88	J/mol×K	713.73	Joback Calculated Property
Cp,gas	407.72	J/mol×K	747.33	Joback Calculated Property
Cp,gas	416.88	J/mol×K	780.93	Joback Calculated Property
Cp,gas	425.41	J/mol×K	814.53	Joback Calculated Property

Similar Compounds

Find more compounds similar to N,N-dimethylphenylglycine.

Sources

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

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