5-Bromo-2-[(4,6-dimethylpyrimidin-2-yl)amino]benzoic acid
5-bromo-2-[(4,6-dimethylpyrimidin-2-yl)amino]benzoic acid
Also Known As: BAS 09524990|5-Bromo-2-[(4,6-dimethyl-2-pyrimidinyl)amino]benzoic acid|5-bromo-2-[(4,6-dimethylpyrimidin-2-yl)amino]benzoic acid|5-Bromo-2-(4,6-dimethyl-pyrimidin-2-ylamino)-benzoic acid
CAS: 856437-62-2
| Molecular Formula | C13H12BrN3O2 |
|---|---|
| Molecular Weight | 321.0113 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 75.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 321.0113 |
| Monoisotopic Mass | 321.0113 |
| Heavy Atoms | 19 |
| Complexity | 319.0 |
Chemical Identifiers
| CAS Number | 856437-62-2 |
|---|---|
| SMILES | CC1=CC(=NC(=N1)NC2=C(C=C(C=C2)Br)C(=O)O)C |
| InChIKey | PIHHZGSKJLIUAI-UHFFFAOYSA-N |
Product Overview
5-Bromo-2-[(4,6-dimethylpyrimidin-2-yl)amino]benzoic acid (CAS 856437-62-2), with molecular formula C13H12BrN3O2 and molecular weight 321.0113 g/mol. IUPAC: 5-bromo-2-[(4,6-dimethylpyrimidin-2-yl)amino]benzoic acid.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
5-Bromo-2-[(4,6-dimethylpyrimidin-2-yl)amino]benzoic acid is a custom synthesis product. We offer services from milligram to kilogram scale.
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