| CAS Number | 2060031-17-4 |
| Catalog Number | AG01BVOJ |
| Chemical Name | 6-benzyl-6-azaspiro[3.4]octane-8-carboxylic acid hydrochloride |
| IUPAC Name | 6-benzyl-6-azaspiro[3.4]octane-8-carboxylic acid;hydrochloride |
| InChI | InChI=1S/C15H19NO2.ClH/c17-14(18)13-10-16(11-15(13)7-4-8-15)9-12-5-2-1-3-6-12;/h1-3,5-6,13H,4,7-11H2,(H,17,18);1H |
| InChI Key | GELUKVDONXSYQV-UHFFFAOYSA-N |
| MDL Number | MFCD30497601 |
| Molecular Formula | C15H20ClNO2 |
| Molecular Weight | 281.7778 |
| SMILES | Cl.OC(C1C2(CCC2)CN(CC2=CC=CC=C2)C1)=O |
| Synonyms | 6-benzyl-6-azaspiro[3.4]octane-8-carboxylic acid hydrochloride,
2060031-17-4,
Z2738925486,
|
| Complexity | 319 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 281.118g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 281.78g/mol |
| Monoisotopic Mass | 281.118g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 40.5A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number