Chemical Properties of 4-(Aminomethyl)pyridine (CAS 3731-53-1)

InChI

InChI=1S/C6H8N2/c7-5-6-1-3-8-4-2-6/h1-4H,5,7H2

InChI Key

TXQWFIVRZNOPCK-UHFFFAOYSA-N

Formula

C6H8N2

SMILES

NCc1ccncc1

Molecular Weight¹

108.14

CAS

3731-53-1

Other Names

• 4-Picolylamine
• (4-Pyridylmethyl)amine
• 4-Pyridinemethanamine
• Pyridine, 4-(aminomethyl)-
• 4-Picolinamine
• 4-Picolinylamine
• 4-Pyridinemethylamine
• 4-Pyridinylmethanamine
• NSC 59707
• «gamma»-Picolylamine

• ω : Acentric Factor.
• Δ_fH°_gas : Enthalpy of formation 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.
• I : Polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_boilr : Boiling point at reduced pressure (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ω	0.4268		Relay (1.0) Calculated Property
ΔfH°gas	125.75	kJ/mol	Relay (1.0) Calculated Property
ΔvapH°	57.68	kJ/mol	Relay (1.0) Calculated Property
IE	9.18	eV	Relay (1.0) Calculated Property
log10WS	0.71		Relay (1.0) Calculated Property
logPoct/wat	0.540		Crippen Calculated Property
McVol	91.600	ml/mol	McGowan Calculated Property
Pc	4668.83	kPa	Relay (1.0-beta) Calculated Property
Inp	[1076.70; 1130.00]
Inp	1076.70		NIST
Inp	1130.00		NIST
I	[1879.00; 1879.00]
I	1879.00		NIST
I	1879.00		NIST
Tboil	503.20	K	NIST
Tc	712.10	K	Relay (1.0) Calculated Property
Tfus	287.68	K	Relay (1.0) Calculated Property

Cheméo can also estimate Critical Volume, Standard Gibbs free energy of formation for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Pressure Dependent Properties

Similar Compounds

Find more compounds similar to 4-(Aminomethyl)pyridine.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• McGowan Method
• NIST Webbook

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