| CAS Number | 1788624-79-2 |
| Catalog Number | AG01BD9P(AGN-PC-0WOUKY) |
| Chemical Name | 2-(5-amino-4-bromo-1H-pyrazol-1-yl)acetic acid hydrobromide |
| IUPAC Name | 2-(5-amino-4-bromopyrazol-1-yl)acetic acid;hydrobromide |
| InChI | InChI=1S/C5H6BrN3O2.BrH/c6-3-1-8-9(5(3)7)2-4(10)11;/h1H,2,7H2,(H,10,11);1H |
| InChI Key | DMNPVYBPDPZQGN-UHFFFAOYSA-N |
| MDL Number | MFCD28012442 |
| Molecular Formula | C5H7Br2N3O2 |
| Molecular Weight | 300.9360 |
| SMILES | Br.NC1N(CC(O)=O)N=CC=1Br |
| Synonyms | 2-(5-amino-4-bromo-1H-pyrazol-1-yl)acetic acid hydrobromide,
1788624-79-2,
AKOS026743884,
MCULE-1052268268,
NE27906,
Z1834265768,
|
| Complexity | 166 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 300.888g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 300.938g/mol |
| Monoisotopic Mass | 298.891g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 81.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number