| CAS Number | 1416176-10-7 |
| Catalog Number | AG01DW0Y(AGN-PC-0WNXG0) |
| Chemical Name | tert-Butyl 1-formyl-6-azaspiro[2.5]octane-6-carboxylate |
| IUPAC Name | tert-butyl 2-formyl-6-azaspiro[2.5]octane-6-carboxylate |
| InChI | InChI=1S/C13H21NO3/c1-12(2,3)17-11(16)14-6-4-13(5-7-14)8-10(13)9-15/h9-10H,4-8H2,1-3H3 |
| InChI Key | AYPWHPMMQKXDAE-UHFFFAOYSA-N |
| MDL Number | MFCD22396492 |
| Molecular Formula | C13H21NO3 |
| Molecular Weight | 239.3107 |
| SMILES | C(=O)C1CC12CCN(CC2)C(=O)OC(C)(C)C |
| Synonyms | 1416176-10-7,
TERT-BUTYL 1-FORMYL-6-AZASPIRO[2.5]OCTANE-6-CARBOXYLATE,
SCHEMBL14316377,
6-Azaspiro[2.5]octane-6-carboxylic acid, 1-formyl-, 1,1-dimethylethyl ester,
|
| Complexity | 324 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 239.152g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 239.315g/mol |
| Monoisotopic Mass | 239.152g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 46.6A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number