Home Halogens 2-Pyridinecarboxylic acid, 6-bromo-3-methoxy-

2-Pyridinecarboxylic acid, 6-bromo-3-methoxy-

CAS No.:
1256810-26-0
Catalog Number:
AG000OES
Molecular Formula:
C7H6BrNO3
Molecular Weight:
232.0314
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Product Description
Catalog Number:
AG000OES
Chemical Name:
2-Pyridinecarboxylic acid, 6-bromo-3-methoxy-
CAS Number:
1256810-26-0
Molecular Formula:
C7H6BrNO3
Molecular Weight:
232.0314
MDL Number:
MFCD11846420
IUPAC Name:
6-bromo-3-methoxypyridine-2-carboxylic acid
InChI:
InChI=1S/C7H6BrNO3/c1-12-4-2-3-5(8)9-6(4)7(10)11/h2-3H,1H3,(H,10,11)
InChI Key:
KRGGGVKGKFLABG-UHFFFAOYSA-N
SMILES:
COc1ccc(nc1C(=O)O)Br
Properties
Complexity:
176  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.953g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
232.033g/mol
Monoisotopic Mass:
230.953g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
59.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties