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Home > Bromides > 1785601-94-6
1785601-94-6 | Pyridine, 5-bromo-2-(1-methyl-1H-pyrazol-5-yl)-
CAS No: 1785601-94-6 Catalog No: AG00265E MDL No:
Product Description
Catalog Number:
AG00265E
Chemical Name:
Pyridine, 5-bromo-2-(1-methyl-1H-pyrazol-5-yl)-
CAS Number:
1785601-94-6
Molecular Formula:
C9H8BrN3
Molecular Weight:
238.0839
IUPAC Name:
5-bromo-2-(2-methylpyrazol-3-yl)pyridine
InChI:
InChI=1S/C9H8BrN3/c1-13-9(4-5-12-13)8-3-2-7(10)6-11-8/h2-6H,1H3
InChI Key:
YEEVYGUZMRIKTI-UHFFFAOYSA-N
SMILES:
Brc1ccc(nc1)c1ccnn1C
Properties
Complexity:
176
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.99g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
238.088g/mol
Monoisotopic Mass:
236.99g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
30.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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