| CAS Number | 1820580-13-9 |
| Catalog Number | AG00J2FV(AGN-PC-0WRAOL) |
| Chemical Name | (1S,4R,7R)-2-Azabicyclo[2.2.1]heptane-7-carboxylic acid hydrochloride |
| IUPAC Name | (1S,4S)-2-azabicyclo[2.2.1]heptane-7-carboxylic acid;hydrochloride |
| InChI | InChI=1S/C7H11NO2.ClH/c9-7(10)6-4-1-2-5(6)8-3-4;/h4-6,8H,1-3H2,(H,9,10);1H/t4-,5+,6?;/m1./s1 |
| InChI Key | CEKJAWLBBNVOSD-OPYDDUKUSA-N |
| MDL Number | MFCD00245978 |
| Molecular Formula | C7H12ClNO2 |
| Molecular Weight | 177.6287 |
| SMILES | Cl.[C@H]12NC[C@H](CC1)[C@H]2C(=O)O |
| Synonyms | (1S,4R,7R)-2-Azabicyclo[2.2.1]heptane-7-carboxylic acid hydrochloride,
1820580-13-9,
|
| Complexity | 169 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 2 |
| 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 | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number