| CAS Number | 1803565-99-2 |
| Catalog Number | AG01B8KB |
| Chemical Name | azocane-2-carboxylic acid hydrochloride |
| IUPAC Name | azocane-2-carboxylic acid;hydrochloride |
| InChI | InChI=1S/C8H15NO2.ClH/c10-8(11)7-5-3-1-2-4-6-9-7;/h7,9H,1-6H2,(H,10,11);1H |
| InChI Key | SGSJEVCYTWHFER-UHFFFAOYSA-N |
| MDL Number | MFCD28246545 |
| Molecular Formula | C8H16ClNO2 |
| Molecular Weight | 193.6711 |
| SMILES | Cl.OC(C1NCCCCCC1)=O |
| Synonyms | azocane-2-carboxylic acid hydrochloride,
1803565-99-2,
Z1998612770,
|
| Complexity | 136 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 193.087g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 193.671g/mol |
| Monoisotopic Mass | 193.087g/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