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166196-52-7

166196-52-7 | Pyridine, 2-(4-bromo-1H-pyrazol-3-yl)-

CAS No: 166196-52-7 Catalog No: AG001WKN MDL No:MFCD14657914

Product Description

Catalog Number:
AG001WKN
Chemical Name:
Pyridine, 2-(4-bromo-1H-pyrazol-3-yl)-
CAS Number:
166196-52-7
Molecular Formula:
C8H6BrN3
Molecular Weight:
224.0573
MDL Number:
MFCD14657914
IUPAC Name:
2-(4-bromo-1H-pyrazol-5-yl)pyridine
InChI:
InChI=1S/C8H6BrN3/c9-6-5-11-12-8(6)7-3-1-2-4-10-7/h1-5H,(H,11,12)
InChI Key:
IJIUJGQXEDRMIM-UHFFFAOYSA-N
SMILES:
Brc1c[nH]nc1c1ccccn1

Properties

Complexity:
153  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.975g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
224.061g/mol
Monoisotopic Mass:
222.975g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  

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