Name: 4-(2-Aminoanilino)pyridine
SKU: 65053-26-1

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Basic Information

Molecular Structure:
CAS No.:	65053-26-1
Name:	4-(2-Aminoanilino)pyridine
Article Data:	3

Formula:	C₁₁H₁₁N₃
Molecular Weight:	185.228
Synonyms:	1,2-Benzenediamine,N-4-pyridinyl- (9CI);N-(Pyridin-4-yl)benzene-1,2-diamine;NSC 155702;
Density:	1.226 g/cm³
Melting Point:	173.5 °C
Boiling Point:	359 °C at 760 mmHg
Flash Point:	170.9 °C
PSA:	50.94000
LogP:	3.06160

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Specification

The CAS registry number of 1,2-Benzenediamine,N1-4-pyridinyl- is 65053-26-1. The systematic name is N-(pyridin-4-yl)benzene-1,2-diamine. In addition, the molecular formula is C₁₁H₁₁N₃ and the molecular weight is 185.23. What's more, it can be used as an intermediate to prepare Timiperone. And it should be stored in a cool and dry place.

Physical properties about this chemical are: (1)ACD/LogP: 0.52; (2)ACD/LogD (pH 7.4): 0.49; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1.35; (5)ACD/KOC (pH 5.5): 5.44; (6)ACD/KOC (pH 7.4): 42.13; (7)#H bond acceptors: 3; (8)#H bond donors: 3; (9)#Freely Rotating Bonds: 3; (10)Polar Surface Area: 19.37 Å²; (11)Index of Refraction: 1.693; (12)Molar Refractivity: 57.95 cm³; (13)Molar Volume: 150.9 cm³; (14)Polarizability: 22.97 ×10^-24cm³; (15)Surface Tension: 60.2 dyne/cm; (16)Density: 1.226 g/cm³; (17)Flash Point: 170.9 °C; (18)Enthalpy of Vaporization: 60.45 kJ/mol; (19)Boiling Point: 359 °C at 760 mmHg; (20)Vapour Pressure: 2.46E-05 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: n2ccc(Nc1c(N)cccc1)cc2
(2)InChI: InChI=1/C11H11N3/c12-10-3-1-2-4-11(10)14-9-5-7-13-8-6-9/h1-8H,12H2,(H,13,14)
(3)InChIKey: WDRQNOGGIOMQNA-UHFFFAOYAV