| CAS Number | 1501781-14-1 |
| Catalog Number | AG01DVF4 |
| Chemical Name | tert-butyl 5-thia-2,8-diazaspiro[3.4]octane-2-carboxylate |
| IUPAC Name | tert-butyl 5-thia-2,8-diazaspiro[3.4]octane-2-carboxylate |
| InChI | InChI=1S/C10H18N2O2S/c1-9(2,3)14-8(13)12-6-10(7-12)11-4-5-15-10/h11H,4-7H2,1-3H3 |
| InChI Key | IQXCDAYJRMWENW-UHFFFAOYSA-N |
| MDL Number | MFCD23920100 |
| Molecular Formula | C10H18N2O2S |
| Molecular Weight | 230.3271 |
| SMILES | CC(OC(N1CC2(SCCN2)C1)=O)(C)C |
| Synonyms | tert-butyl 5-thia-2,8-diazaspiro[3.4]octane-2-carboxylate,
1501781-14-1,
AKOS019062042,
|
| Complexity | 269 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 230.109g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 230.326g/mol |
| Monoisotopic Mass | 230.109g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 66.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number