| CAS Number | 1989671-42-2 |
| Catalog Number | AG01B6U9 |
| Chemical Name | ethyl (1s)-2-azabicyclo[2.1.1]hexane-1-carboxylate hydrochloride |
| IUPAC Name | ethyl 2-azabicyclo[2.1.1]hexane-1-carboxylate;hydrochloride |
| InChI | InChI=1S/C8H13NO2.ClH/c1-2-11-7(10)8-3-6(4-8)5-9-8;/h6,9H,2-5H2,1H3;1H |
| InChI Key | ZMXSRWMKIWNDEA-UHFFFAOYSA-N |
| MDL Number | MFCD30342948 |
| Molecular Formula | C8H14ClNO2 |
| Molecular Weight | 191.6553 |
| SMILES | Cl.CCOC([C@]12NC[C@H](C1)C2)=O |
| Synonyms | ethyl 2-azabicyclo[2.1.1]hexane-1-carboxylate hydrochloride,
1989671-42-2,
Z2583036358,
|
| Complexity | 185 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 191.071g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 191.655g/mol |
| Monoisotopic Mass | 191.071g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 38.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number