4-Pyridinamine,N-(phenylmethyl)- supplier

Name
4-Benzylaminopyridine
EINECS
CAS No. 13556-71-3
Article Data31
CAS DataBase
Density 1.131 g/cm³
Solubility
Melting Point 108-109.5 °C
Formula C₁₂H₁₂N₂
Boiling Point 330.8 °C at 760 mmHg
Molecular Weight 184.241
Flash Point 153.8 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 4-(Benzylamino)pyridine;Pyridine,4-(benzylamino)- (6CI,8CI);
PSA 24.92000
LogP 2.76670

4-Pyridinamine,N-(phenylmethyl)- Specification

The 4-Pyridinamine,N-(phenylmethyl)- is an organic compound with the formula C₁₂H₁₂N₂. The IUPAC name of this chemical is N-benzylpyridin-4-amine. With the CAS registry number 13556-71-3, it is also named as Benzyl-pyridin-4-yl-amine.

Physical properties about 4-Pyridinamine,N-(phenylmethyl)- are: (1)ACD/LogP: 1.64; (2)ACD/LogD (pH 5.5): 0.32; (3)ACD/LogD (pH 7.4): 1.74; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 7.54; (6)ACD/KOC (pH 5.5): 3.17; (7)ACD/KOC (pH 7.4): 82.95; (8)#H bond acceptors: 2; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 3; (11)Polar Surface Area: 16.13 Å²; (12)Index of Refraction: 1.636; (13)Molar Refractivity: 58.44 cm³; (14)Molar Volume: 162.8 cm³; (15)Polarizability: 23.16×10^-24cm³; (16)Surface Tension: 49.7 dyne/cm; (17)Density: 1.131 g/cm³; (18)Flash Point: 153.8 °C; (19)Enthalpy of Vaporization: 57.34 kJ/mol; (20)Boiling Point: 330.8 °C at 760 mmHg; (21)Vapour Pressure: 0.000163 mmHg at 25°C.

Uses of 4-Pyridinamine,N-(phenylmethyl)-: it can be used to produce pyridin-4-ylamine at ambient temperature. It will need reagent H2SO4 with reaction time of 24 hours. The yield is about 78%.

You can still convert the following datas into molecular structure:
(1)SMILES: n2ccc(NCc1ccccc1)cc2
(2)InChI: InChI=1/C12H12N2/c1-2-4-11(5-3-1)10-14-12-6-8-13-9-7-12/h1-9H,10H2,(H,13,14)
(3)InChIKey: LCUREJHJUJCKQS-UHFFFAOYAT
(4)Std. InChI: InChI=1S/C12H12N2/c1-2-4-11(5-3-1)10-14-12-6-8-13-9-7-12/h1-9H,10H2,(H,13,14)
(5)Std. InChIKey: LCUREJHJUJCKQS-UHFFFAOYSA-N

Product Name

4-Benzylaminopyridine

4-Pyridinamine,N-(phenylmethyl)- Specification

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