| CAS Number | 2098589-07-0 |
| Catalog Number | AG019FP2(AGN-PC-3H45C0) |
| Chemical Name | tert-butyl rac-(1S,2S,4R)-7-azabicyclo[2.2.1]hept-2-ylcarbamate hydrochloride |
| IUPAC Name | tert-butyl N-[(1S,2S,4R)-7-azabicyclo[2.2.1]heptan-2-yl]carbamate;hydrochloride |
| InChI | InChI=1S/C11H20N2O2.ClH/c1-11(2,3)15-10(14)13-9-6-7-4-5-8(9)12-7;/h7-9,12H,4-6H2,1-3H3,(H,13,14);1H/t7-,8+,9+;/m1./s1 |
| InChI Key | CTUPSFKVOJMISH-KEMIKLHMSA-N |
| MDL Number | MFCD30470660 |
| Molecular Formula | C11H21ClN2O2 |
| Molecular Weight | 248.7496 |
| SMILES | C(=O)(OC(C)(C)C)N[C@H]1C[C@@H]2N[C@H]1CC2.Cl |
| Synonyms | 2098589-07-0,
tert-Butyl (1S,2S,4R)-7-azabicyclo[2.2.1]heptan-2-ylcarbamate hydrochloride,
tert-butyl rac-(1S,2S,4R)-7-azabicyclo[2.2.1]hept-2-ylcarbamate hydrochloride,
2008714-28-9,
MFCD28891992,
AKOS030631071,
t-Butyl rac-(1S,2s,4R)-7-azabicyclo[2.2.1]hept-2-ylcarbamate hydrochloride,
|
| Complexity | 260 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 3 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 248.129g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 248.751g/mol |
| Monoisotopic Mass | 248.129g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 50.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number