| CAS Number | 1402672-55-2 |
| Catalog Number | AG01A4F6(AGN-PC-0WO0BQ) |
| Chemical Name | 5-Amino-6-bromopyridine-2-carboxylic acid |
| IUPAC Name | 5-amino-6-bromopyridine-2-carboxylic acid |
| InChI | InChI=1S/C6H5BrN2O2/c7-5-3(8)1-2-4(9-5)6(10)11/h1-2H,8H2,(H,10,11) |
| InChI Key | IYCCTGRKKBYYNE-UHFFFAOYSA-N |
| MDL Number | MFCD23701859 |
| Molecular Formula | C6H5BrN2O2 |
| Molecular Weight | 217.0201 |
| SMILES | O=C(C1=NC(Br)=C(N)C=C1)O |
| Synonyms | 5-amino-6-bromopicolinic acid,
5-amino-6-bromopyridine-2-carboxylic acid,
1402672-55-2,
ZINC84312943,
AKOS023413075,
NE35878,
|
| 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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Certificate of Analysis
Lot Number