| CAS Number | 1955531-53-9 |
| Catalog Number | AG01C1SW |
| Chemical Name | 1-(2-Bromoethyl)-1H-pyrazole hydrobromide |
| IUPAC Name | 1-(2-bromoethyl)pyrazole;hydrobromide |
| InChI | InChI=1S/C5H7BrN2.BrH/c6-2-5-8-4-1-3-7-8;/h1,3-4H,2,5H2;1H |
| InChI Key | OCDXQTCMYCZKKW-UHFFFAOYSA-N |
| MDL Number | MFCD29054889 |
| Molecular Formula | C5H8Br2N2 |
| Molecular Weight | 255.9384 |
| SMILES | Br.BrCCN1N=CC=C1 |
| Synonyms | 1-(2-bromoethyl)-1H-pyrazole hydrobromide,
1955531-53-9,
|
| Complexity | 67.4 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 255.903g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 255.941g/mol |
| Monoisotopic Mass | 253.905g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 17.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number