Chemical Properties of Benzoic acid, 2-(methylamino)-, propyl ester (CAS 55320-72-4)

InChI

InChI=1S/C11H15NO2/c1-3-8-14-11(13)9-6-4-5-7-10(9)12-2/h4-7,12H,3,8H2,1-2H3

InChI Key

FRPUEBLBJZHNFU-UHFFFAOYSA-N

Formula

C11H15NO2

SMILES

CCCOC(=O)c1ccccc1NC

Molecular Weight¹

193.24

CAS

55320-72-4

Other Names

• n-Propyl N-methyl anthranilate
• Propyl N-methyl anthranylate

• 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.
• 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
ΔfG°	-0.01	kJ/mol	Joback Calculated Property
ΔfH°gas	-236.64	kJ/mol	Joback Calculated Property
ΔfusH°	25.78	kJ/mol	Joback Calculated Property
ΔvapH°	58.61	kJ/mol	Joback Calculated Property
log10WS	-2.56		Crippen Calculated Property
logPoct/wat	2.295		Crippen Calculated Property
McVol	159.510	ml/mol	McGowan Calculated Property
Pc	2773.00	kPa	Joback Calculated Property
Inp	[1560.00; 1560.00]
Inp	1560.00		NIST
Inp	1560.00		NIST
I	[2166.00; 2166.00]
I	2166.00		NIST
I	2166.00		NIST
Tboil	609.20	K	Joback Calculated Property
Tc	819.40	K	Joback Calculated Property
Tfus	377.49	K	Joback Calculated Property
Vc	0.603	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[395.72; 468.21]	J/mol×K	[609.20; 819.40]
Cp,gas	395.72	J/mol×K	609.20	Joback Calculated Property
Cp,gas	409.76	J/mol×K	644.23	Joback Calculated Property
Cp,gas	422.99	J/mol×K	679.27	Joback Calculated Property
Cp,gas	435.44	J/mol×K	714.30	Joback Calculated Property
Cp,gas	447.11	J/mol×K	749.33	Joback Calculated Property
Cp,gas	458.03	J/mol×K	784.36	Joback Calculated Property
Cp,gas	468.21	J/mol×K	819.40	Joback Calculated Property

Similar Compounds

Find more compounds similar to Benzoic acid, 2-(methylamino)-, propyl ester.

Sources

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

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