Chemical Properties of Benzylamine, n-(o-nitrophenyl)- (CAS 5729-06-6)

InChI

InChI=1S/C13H12N2O2/c16-15(17)13-9-5-4-8-12(13)14-10-11-6-2-1-3-7-11/h1-9,14H,10H2

InChI Key

LAOUKNRSKBRAMQ-UHFFFAOYSA-N

Formula

C13H12N2O2

SMILES

O=[N+]([O-])c1ccccc1NCc1ccccc1

Molecular Weight¹

228.25

CAS

5729-06-6

• 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).
• 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

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[473.05; 536.77]	J/mol×K	[757.19; 1020.62]
Cp,gas	473.05	J/mol×K	757.19	Joback Calculated Property
Cp,gas	486.47	J/mol×K	801.09	Joback Calculated Property
Cp,gas	498.63	J/mol×K	845.00	Joback Calculated Property
Cp,gas	509.64	J/mol×K	888.90	Joback Calculated Property
Cp,gas	519.60	J/mol×K	932.81	Joback Calculated Property
Cp,gas	528.61	J/mol×K	976.71	Joback Calculated Property
Cp,gas	536.77	J/mol×K	1020.62	Joback Calculated Property

Similar Compounds

Find more compounds similar to Benzylamine, n-(o-nitrophenyl)-.

Sources

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

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