| CAS Number | 1803587-96-3 |
| Catalog Number | AG01BH5E |
| Chemical Name | 3,9-dioxa-7-azabicyclo[3.3.1]nonane hydrochloride |
| IUPAC Name | 3,9-dioxa-7-azabicyclo[3.3.1]nonane;hydrochloride |
| InChI | InChI=1S/C6H11NO2.ClH/c1-5-3-8-4-6(9-5)2-7-1;/h5-7H,1-4H2;1H |
| InChI Key | QMKGVKGYYPNDLO-UHFFFAOYSA-N |
| MDL Number | MFCD28139514 |
| Molecular Formula | C6H12ClNO2 |
| Molecular Weight | 165.6180 |
| SMILES | Cl.C1C2OC(COC2)CN1 |
| Synonyms | 3,9-dioxa-7-azabicyclo[3.3.1]nonane hydrochloride,
1803587-96-3,
AKOS025399354,
Z2158595309,
3,9-dioxa-7-azabicyclo[3.3.1]nonane hydrochloride salt,
|
| Complexity | 97.2 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 165.056g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 165.617g/mol |
| Monoisotopic Mass | 165.056g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 30.5A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number