| CAS Number | 1250996-34-9 |
| Catalog Number | AG01EKHD |
| Chemical Name | 8-AZA-SPIRO[4.5]DECANE-1,8-DICARBOXYLIC ACID 8-TERT-BUTYL ESTER |
| IUPAC Name | 8-[(2-methylpropan-2-yl)oxycarbonyl]-8-azaspiro[4.5]decane-4-carboxylic acid |
| InChI | InChI=1S/C15H25NO4/c1-14(2,3)20-13(19)16-9-7-15(8-10-16)6-4-5-11(15)12(17)18/h11H,4-10H2,1-3H3,(H,17,18) |
| InChI Key | YACOCSGNAPWKKA-UHFFFAOYSA-N |
| MDL Number | MFCD18792439 |
| Molecular Formula | C15H25NO4 |
| Molecular Weight | 283.3633 |
| SMILES | O=C(C1CCCC12CCN(C(OC(C)(C)C)=O)CC2)O |
| Synonyms | 1250996-34-9,
8-(tert-Butoxycarbonyl)-8-azaspiro[4.5]decane-1-carboxylic acid,
AKOS034139108,
8-AZA-SPIRO[4.5]DECANE-1,8-DICARBOXYLIC ACID 8-TERT-BUTYL ESTER,
|
| Complexity | 391 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 283.178g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 20 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 283.368g/mol |
| Monoisotopic Mass | 283.178g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 66.8A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.5 |
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Certificate of Analysis
Lot Number