| CAS Number | 1388054-56-5 |
| Catalog Number | AG01BUP6 |
| Chemical Name | 3-(3-bromophenyl)azetidin-3-ol |
| IUPAC Name | 3-(3-bromophenyl)azetidin-3-ol |
| InChI | InChI=1S/C9H10BrNO/c10-8-3-1-2-7(4-8)9(12)5-11-6-9/h1-4,11-12H,5-6H2 |
| InChI Key | SUWQFRXKQNRNHH-UHFFFAOYSA-N |
| MDL Number | MFCD22563082 |
| Molecular Formula | C9H10BrNO |
| Molecular Weight | 228.0858 |
| SMILES | OC1(C2=CC(Br)=CC=C2)CNC1 |
| Synonyms | 3-(3-bromophenyl)azetidin-3-ol,
1388054-56-5,
AKOS023908766,
ZINC222215292,
Z2658863336,
|
| Complexity | 170 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 226.995g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 228.089g/mol |
| Monoisotopic Mass | 226.995g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 32.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number