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25194-52-9 | 2-Pyridinecarboxamide, 6-bromo-
CAS No: 25194-52-9 Catalog No: AG002QUO MDL No:MFCD00234154
Product Description
Catalog Number:
AG002QUO
Chemical Name:
2-Pyridinecarboxamide, 6-bromo-
CAS Number:
25194-52-9
Molecular Formula:
C6H5BrN2O
Molecular Weight:
201.0207
MDL Number:
MFCD00234154
IUPAC Name:
6-bromopyridine-2-carboxamide
InChI:
InChI=1S/C6H5BrN2O/c7-5-3-1-2-4(9-5)6(8)10/h1-3H,(H2,8,10)
InChI Key:
HWRUOHMDYQEWOD-UHFFFAOYSA-N
SMILES:
Brc1cccc(n1)C(=O)N
Properties
Complexity:
140
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.959g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
201.023g/mol
Monoisotopic Mass:
199.959g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
56A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
Literature
| Title | Journal |
|---|---|
| 6-Bromo-pyridine-2-carboxamide. | Acta crystallographica. Section E, Structure reports online 20091201 |
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