| CAS Number | 109640-45-1 |
| Catalog Number | AG01BKF8 |
| Chemical Name | 5-thia-8-azaspiro[3.4]octane |
| IUPAC Name | 5-thia-8-azaspiro[3.4]octane |
| InChI | InChI=1S/C6H11NS/c1-2-6(3-1)7-4-5-8-6/h7H,1-5H2 |
| InChI Key | FESTXUIXVBKJRG-UHFFFAOYSA-N |
| MDL Number | MFCD23920108 |
| Molecular Formula | C6H11NS |
| Molecular Weight | 129.2232 |
| SMILES | C1CC2(SCCN2)C1 |
| Synonyms | 5-thia-8-azaspiro[3.4]octane,
109640-45-1,
ZINC87602277,
AKOS019061759,
|
| Complexity | 98.7 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 129.061g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 129.221g/mol |
| Monoisotopic Mass | 129.061g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 37.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number