| CAS Number | 1823269-85-7 |
| Catalog Number | AG00I185(AGN-PC-0WG4HG) |
| Chemical Name | Tert-Butyl 4-Oxo-1-Oxa-7-Azaspiro[4.4]Nonane-7-Carboxylate |
| IUPAC Name | tert-butyl 4-oxo-1-oxa-7-azaspiro[4.4]nonane-7-carboxylate |
| InChI | InChI=1S/C12H19NO4/c1-11(2,3)17-10(15)13-6-5-12(8-13)9(14)4-7-16-12/h4-8H2,1-3H3 |
| InChI Key | AQKOZWCHBLIVRA-UHFFFAOYSA-N |
| MDL Number | MFCD27997305 |
| Molecular Formula | C12H19NO4 |
| Molecular Weight | 241.2836 |
| SMILES | O=C1CCOC12CN(CC2)C(=O)OC(C)(C)C |
| Synonyms | tert-Butyl 4-oxo-1-oxa-7-azaspiro[4.4]nonane-7-carboxylate,
1823269-85-7,
MFCD27997305,
CS-0038591,
t-Butyl 4-oxo-1-oxa-7-azaspiro[4.4]nonane-7-carboxylate,
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| Complexity | 347 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 241.131g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 241.287g/mol |
| Monoisotopic Mass | 241.131g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 55.8A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.5 |
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Certificate of Analysis
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