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35235-74-6

Basic Information
CAS No.: 35235-74-6
Name: 6-Bromotetrazolo[1,5-a]pyridine
Article Data: 6
Molecular Structure:
Molecular Structure of 35235-74-6 (6-Bromotetrazolo[1,5-a]pyridine)
Formula: C5H3BrN4
Molecular Weight: 199.01
Synonyms: 6-Bromotetrazolo[1,5-a]pyridine;
Density: 2.13 g/cm3
Melting Point: 156-158 °C
Hazard Symbols: IrritantXi
PSA: 43.08000
LogP: 0.88680
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  • 6-BROMOTETRAZOLO[1,5-A]PYRIDINE  CAS NO.35235-74-6

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Specification

The Tetrazolo[1,5-a]pyridine,6-bromo- has the CAS registry number 35235-74-6. It belongs to the product categories of Blocks; Bromides; Imidazoles; Pyridines. This chemical's molecular formula is C5H3BrN4 and molecular weight is 199.008. What's more, its systematic name is 6-bromotetrazolo[1,5-a]pyridine. 

Physical properties of Tetrazolo[1,5-a]pyridine,6-bromo- are: (1)ACD/LogP: 0.67; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1; (4)ACD/BCF (pH 5.5): 4; (5)ACD/KOC (pH 5.5): 93; (6)#H bond acceptors: 4; (7)#H bond donors: 0; (8)#Freely Rotating Bonds: 0; (9)Polar Surface Area: 43.08 Å2; (10)Index of Refraction: 1.835; (11)Molar Refractivity: 41.16 cm3; (12)Molar Volume: 93.322 cm3; (13)Surface Tension: 75.13 dyne/cm; (14)Density: 2.133 g/cm3.

You can still convert the following datas into molecular structure:
(1)SMILES: Brc1ccc2nnnn2c1
(2)InChI: InChI=1S/C5H3BrN4/c6-4-1-2-5-7-8-9-10(5)3-4/h1-3H
(3)InChIKey: BZQNWLUCQRIYFF-UHFFFAOYSA-N