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1221629-04-4 | 2-Pyridinecarboxylic acid, 6-amino-5-bromo-
CAS No: 1221629-04-4 Catalog No: AG0016UG MDL No:MFCD08062949
Product Description
Catalog Number:
AG0016UG
Chemical Name:
2-Pyridinecarboxylic acid, 6-amino-5-bromo-
CAS Number:
1221629-04-4
Molecular Formula:
C6H5BrN2O2
Molecular Weight:
217.0201
MDL Number:
MFCD08062949
IUPAC Name:
6-amino-5-bromopyridine-2-carboxylic acid
InChI:
InChI=1S/C6H5BrN2O2/c7-3-1-2-4(6(10)11)9-5(3)8/h1-2H,(H2,8,9)(H,10,11)
InChI Key:
SXKGMTDVECHQRI-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc(c(n1)N)Br
Properties
Complexity:
165
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.953g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
217.022g/mol
Monoisotopic Mass:
215.953g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
76.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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