| CAS Number | 1823330-65-9 |
| Catalog Number | AG01DJQ2 |
| Chemical Name | tert-butyl 5-oxa-2-azaspiro[3.4]oct-7-ene-2-carboxylate |
| IUPAC Name | tert-butyl 5-oxa-2-azaspiro[3.4]oct-7-ene-2-carboxylate |
| InChI | InChI=1S/C11H17NO3/c1-10(2,3)15-9(13)12-7-11(8-12)5-4-6-14-11/h4-5H,6-8H2,1-3H3 |
| InChI Key | LIBBJPJHINROLG-UHFFFAOYSA-N |
| MDL Number | MFCD27978691 |
| Molecular Formula | C11H17NO3 |
| Molecular Weight | 211.2576 |
| SMILES | CC(C)(C)OC(=O)N1CC2(C1)OCC=C2 |
| Synonyms | tert-butyl 5-Oxa-2-azaspiro[3.4]oct-7-ene-2-carboxylate,
1823330-65-9,
|
| Complexity | 297 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 211.121g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 211.261g/mol |
| Monoisotopic Mass | 211.121g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 38.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.8 |
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Certificate of Analysis
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