| CAS Number | 1823500-42-0 |
| Catalog Number | AG00I19R(AGN-PC-0WR2OT) |
| Chemical Name | BENZYL 8-AMINO-5-AZASPIRO[2.5]OCTANE-5-CARBOXYLATE HCL |
| IUPAC Name | benzyl 8-amino-5-azaspiro[2.5]octane-5-carboxylate;hydrochloride |
| InChI | InChI=1S/C15H20N2O2.ClH/c16-13-6-9-17(11-15(13)7-8-15)14(18)19-10-12-4-2-1-3-5-12;/h1-5,13H,6-11,16H2;1H |
| InChI Key | SFWDWAKAWFKOHT-UHFFFAOYSA-N |
| MDL Number | MFCD28053770 |
| Molecular Formula | C15H21ClN2O2 |
| Molecular Weight | 296.7924 |
| SMILES | Cl.NC1CCN(CC11CC1)C(=O)OCC1=CC=CC=C1 |
| Synonyms | 1823500-42-0,
Benzyl 8-amino-5-azaspiro[2.5]octane-5-carboxylate HCl,
Benzyl 8-amino-5-azaspiro[2.5]octane-5-carboxylate hydrochloride,
MFCD28053770,
AS-41868,
CS-0067243,
|
| Complexity | 335 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 296.129g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 20 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 296.795g/mol |
| Monoisotopic Mass | 296.129g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 55.6A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number