| CAS Number | 1434141-78-2 |
| Catalog Number | AG00IKMP(AGN-PC-0WD8V2) |
| Chemical Name | tert-butyl2-oxo-5-azaspiro[3.4]octane-5-carboxylate |
| IUPAC Name | tert-butyl 2-oxo-5-azaspiro[3.4]octane-5-carboxylate |
| InChI | InChI=1S/C12H19NO3/c1-11(2,3)16-10(15)13-6-4-5-12(13)7-9(14)8-12/h4-8H2,1-3H3 |
| InChI Key | JQHIUJAHRNWYPJ-UHFFFAOYSA-N |
| MDL Number | MFCD27956954 |
| Molecular Formula | C12H19NO3 |
| Molecular Weight | 225.2842 |
| SMILES | CC(C)(C)OC(=O)N1CCCC11CC(=O)C1 |
| Synonyms | 1434141-78-2,
tert-Butyl 2-oxo-5-azaspiro[3.4]octane-5-carboxylate,
5-Boc-5-aza-spiro[3.4]octane-2-one,
tert-butyl2-oxo-5-azaspiro[3.4]octane-5-carboxylate,
KS-000004CB,
MFCD27956954,
5-Boc-5-azaspiro[3.4]octan-2-one,
ZINC261507534,
SB11324,
AS-52036,
CS-0048405,
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| Complexity | 322 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 225.136g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 225.288g/mol |
| Monoisotopic Mass | 225.136g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 46.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.9 |
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Certificate of Analysis
Lot Number