| CAS Number | 103247-89-8 |
| Catalog Number | AG009M0V |
| Chemical Name | 4-(4-bromophenyl)azetidin-2-one |
| IUPAC Name | 4-(4-bromophenyl)azetidin-2-one |
| InChI | InChI=1S/C9H8BrNO/c10-7-3-1-6(2-4-7)8-5-9(12)11-8/h1-4,8H,5H2,(H,11,12) |
| InChI Key | YSIKXVRYGIZALB-UHFFFAOYSA-N |
| MDL Number | MFCD11849068 |
| Molecular Formula | C9H8BrNO |
| Molecular Weight | 226.0699 |
| SMILES | BrC1=CC=C(C2NC(=O)C2)C=C1 |
| Synonyms | 4-(4-bromophenyl)azetidin-2-one,
103247-89-8,
4-(4-Bromophenyl)-2-azetidinone,
4-(p-bromophenyl)-2-azetidinone,
4-(4-Bromophenyl)azetidine-2-one,
AKOS013992432,
F8884-2283,
Z2512451333,
|
| Complexity | 187 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 224.979g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 226.073g/mol |
| Monoisotopic Mass | 224.979g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 29.1A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.5 |
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Certificate of Analysis
Lot Number