| CAS Number | 1955540-92-7 |
| Catalog Number | AG01B5MA |
| Chemical Name | 4-Methyl-2-azabicyclo[2.1.1]hexane-1-carboxylic Acid Hydrochloride |
| IUPAC Name | 4-methyl-2-azabicyclo[2.1.1]hexane-1-carboxylic acid;hydrochloride |
| InChI | InChI=1S/C7H11NO2.ClH/c1-6-2-7(3-6,5(9)10)8-4-6;/h8H,2-4H2,1H3,(H,9,10);1H |
| InChI Key | XURBUJZHVFABJE-UHFFFAOYSA-N |
| MDL Number | MFCD30181140 |
| Molecular Formula | C7H12ClNO2 |
| Molecular Weight | 177.6287 |
| SMILES | Cl.C[C@]12CN[C@](C(O)=O)(C1)C2 |
| Synonyms | 4-methyl-2-azabicyclo[2.1.1]hexane-1-carboxylic acid hydrochloride,
1955540-92-7,
AKOS033936442,
Z2522872427,
|
| Complexity | 194 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 177.056g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 177.628g/mol |
| Monoisotopic Mass | 177.056g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 49.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number