| CAS Number | 428-61-5 |
| Catalog Number | AG01BV50 |
| Chemical Name | 1-Bromo-2,2-difluorobutane |
| IUPAC Name | 1-bromo-2,2-difluorobutane |
| InChI | InChI=1S/C4H7BrF2/c1-2-4(6,7)3-5/h2-3H2,1H3 |
| InChI Key | QLGQKTGACVBAID-UHFFFAOYSA-N |
| MDL Number | MFCD20625118 |
| Molecular Formula | C4H7BrF2 |
| Molecular Weight | 172.9992 |
| SMILES | CCC(CBr)(F)F |
| Synonyms | 1-bromo-2,2-difluorobutane,
428-61-5,
ZINC200018571,
|
| Complexity | 53.7 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 171.97g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 7 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 173.001g/mol |
| Monoisotopic Mass | 171.97g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 0A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number