| CAS Number | 1955547-53-1 |
| Catalog Number | AG01C64D |
| Chemical Name | 2-[(tert-butoxy)carbonyl]-2-azaspiro[4.5]decane-4-carboxylic acid |
| IUPAC Name | 2-[(2-methylpropan-2-yl)oxycarbonyl]-2-azaspiro[4.5]decane-4-carboxylic acid |
| InChI | InChI=1S/C15H25NO4/c1-14(2,3)20-13(19)16-9-11(12(17)18)15(10-16)7-5-4-6-8-15/h11H,4-10H2,1-3H3,(H,17,18) |
| InChI Key | SRGGDRNFTIRXQP-UHFFFAOYSA-N |
| MDL Number | MFCD29046100 |
| Molecular Formula | C15H25NO4 |
| Molecular Weight | 283.3633 |
| SMILES | CC(OC(N1CC2(CCCCC2)C(C(O)=O)C1)=O)(C)C |
| Synonyms | 2-(tert-butoxycarbonyl)-2-azaspiro[4.5]decane-4-carboxylic acid,
AKOS026706586,
F1907-0924,
2-[(tert-butoxy)carbonyl]-2-azaspiro[4.5]decane-4-carboxylic acid,
1955547-53-1,
|
| Complexity | 393 |
| 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 | 2.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number