Pyridine, 3-(1H-imidazol-2-yl)- supplier

Name
3-(1H-IMIDAZOL-2-YL)-PYRIDINE
EINECS
CAS No. 13570-00-8
Article Data17
CAS DataBase
Density 1.215 g/cm³
Solubility
Melting Point 196-198 °C
Formula C₈H₇N₃
Boiling Point 384.927 °C at 760 mmHg
Molecular Weight 145.164
Flash Point 192.737 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2-(3-Pyridyl)imidazole;
PSA 41.57000
LogP 1.47170

Pyridine, 3-(1H-imidazol-2-yl)- Specification

The Pyridine, 3-(1H-imidazol-2-yl)-, with the CAS registry number 13570-00-8, is also known as 2-(3-Pyridyl)imidazole. This chemical's molecular formula is C₈H₇N₃ and molecular weight is 145.16. What's more, its IUPAC name is 3-(1H-imidazol-2-yl)pyridine.

Physical properties of Pyridine, 3-(1H-imidazol-2-yl)- are: (1)ACD/LogP: 0.40; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0; (4)ACD/LogD (pH 7.4): 0; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 33; (8)ACD/KOC (pH 7.4): 39; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 41.57 Å²; (13)Index of Refraction: 1.611; (14)Molar Refractivity: 41.46 cm³; (15)Molar Volume: 119.488 cm³; (16)Polarizability: 16.436×10^-24cm³; (17)Surface Tension: 57.15 dyne/cm; (18)Density: 1.215 g/cm³; (19)Flash Point: 192.737 °C; (20)Enthalpy of Vaporization: 60.887 kJ/mol; (21)Boiling Point: 384.927 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: c1ncc(cc1)c2nccn2
(2)Std. InChI: InChI=1S/C8H7N3/c1-2-7(6-9-3-1)8-10-4-5-11-8/h1-6H,(H,10,11)
(3)Std. InChIKey: ZQZJULZPQACTES-UHFFFAOYSA-N

Product Name

3-(1H-IMIDAZOL-2-YL)-PYRIDINE

Pyridine, 3-(1H-imidazol-2-yl)- Specification

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