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Basic Information
CAS No.: 25700-14-5
Name: 2-IMIDAZOL-1-YL-PYRIDINE
Article Data: 2
Molecular Structure:
Molecular Structure of 25700-14-5 (2-IMIDAZOL-1-YL-PYRIDINE)
Formula: C8H7N3
Molecular Weight: 145.164
Synonyms: Pyridine,2-imidazol-1-yl- (8CI);1-(Pyridin-2-yl)-1H-imidazole;2-(1H-Imidazol-1-yl)pyridine;2-(Imidazol-1-yl)pyridine;
Density: 1.16 g/cm3
Melting Point: 62-63℃
Boiling Point: 310.6 °C at 760 mmHg
Flash Point: 141.6 °C
PSA: 30.71000
LogP: 1.26730
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Specification

The Pyridine, 2-(1H-imidazol-1-yl)-, with the CAS registry number 25700-14-5, is also known as Pyridinylimidazole. This chemical's molecular formula is C8H7N3 and molecular weight is 145.16. What's more, its systematic name is 2-(1H-Imidazol-1-yl)pyridine.

Physical properties about Pyridine, 2-(1H-imidazol-1-yl)- are: (1)ACD/LogP: 0.49; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.46; (4)ACD/LogD (pH 7.4): 0.49; (5)ACD/BCF (pH 5.5): 1.31; (6)ACD/BCF (pH 7.4): 1.38; (7)ACD/KOC (pH 5.5): 41.55; (8)ACD/KOC (pH 7.4): 43.86; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 30.71 Å2; (13)Index of Refraction: 1.632; (14)Molar Refractivity: 44.37 cm3; (15)Molar Volume: 124.3 cm3; (16)Polarizability: 17.59×10-24 cm3; (17)Surface Tension: 47.9 dyne/cm; (18)Density: 1.16 g/cm3; (19)Flash Point: 141.6 °C; (20)Enthalpy of Vaporization: 52.94 kJ/mol; (21)Boiling Point: 310.6 °C at 760 mmHg; (22)Vapour Pressure: 0.00109 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: n1ccccc1n2ccnc2
(2) InChI: InChI=1/C8H7N3/c1-2-4-10-8(3-1)11-6-5-9-7-11/h1-7H
(3) InChIKey: MIJZSNMJNBVCEB-UHFFFAOYAB