| CAS Number | 1909286-42-5 |
| Catalog Number | AG01C351 |
| Chemical Name | (1r,3r)-3-bromocyclobutan-1-ol |
| IUPAC Name | 3-bromocyclobutan-1-ol |
| InChI | InChI=1S/C4H7BrO/c5-3-1-4(6)2-3/h3-4,6H,1-2H2 |
| InChI Key | HWLHFIFQJICDNX-UHFFFAOYSA-N |
| MDL Number | MFCD29762787 |
| Molecular Formula | C4H7BrO |
| Molecular Weight | 151.0018 |
| SMILES | O[C@@H]1C[C@@H](Br)C1 |
| Synonyms | 1552270-60-6,
3-bromocyclobutan-1-ol,
3-bromocyclobutan-1-ol, trans,
ZINC306721282,
ZINC307459899,
3-bromocyclobutan-1-ol, Mixture of diastereomers,
1909286-42-5,
|
| Complexity | 49.5 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 149.968g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 6 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 151.003g/mol |
| Monoisotopic Mass | 149.968g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 20.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number