| CAS Number | 2197062-92-1 |
| Catalog Number | AG01EFNN |
| Chemical Name | 4-Carbamoyl-1-Azabicyclo[2.2.1]Heptan-1-Ium Bromide |
| IUPAC Name | 1-azoniabicyclo[2.2.1]heptane-4-carboxamide;bromide |
| InChI | InChI=1S/C7H12N2O.BrH/c8-6(10)7-1-3-9(5-7)4-2-7;/h1-5H2,(H2,8,10);1H |
| InChI Key | WUJIFFRXBXWLRV-UHFFFAOYSA-N |
| MDL Number | MFCD28991979 |
| Molecular Formula | C7H13BrN2O |
| Molecular Weight | 221.0949 |
| SMILES | Br.NC(=O)C12CCN(CC1)C2 |
| Synonyms | 4-Carbamoyl-1-azabicyclo[2.2.1]heptan-1-ium bromide,
2197062-92-1,
MFCD28991979,
|
| Complexity | 170 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 220.021g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 221.098g/mol |
| Monoisotopic Mass | 220.021g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 47.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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