| CAS Number | 1803582-31-1 |
| Catalog Number | AG00IL7R(AGN-PC-0WRAJA) |
| Chemical Name | 3λ⁶-thia-9-azaspiro[5.5]undecane-3,3-dione hydrochloride |
| IUPAC Name | 3λ6-thia-9-azaspiro[5.5]undecane 3,3-dioxide;hydrochloride |
| InChI | InChI=1S/C9H17NO2S.ClH/c11-13(12)7-3-9(4-8-13)1-5-10-6-2-9;/h10H,1-8H2;1H |
| InChI Key | HAVVBWKKKAPLMZ-UHFFFAOYSA-N |
| MDL Number | MFCD28954306 |
| Molecular Formula | C9H18ClNO2S |
| Molecular Weight | 239.7627 |
| SMILES | O=S1(=O)CCC2(CC1)CCNCC2.Cl |
| Synonyms | 1803582-31-1,
3-Thia-9-azaspiro[5.5]undecane 3,3-dioxide hydrochloride,
3lambda-thia-9-azaspiro[5.5]undecane-3,3-dione hydrochloride,
3lambda6-thia-9-azaspiro[5.5]undecane-3,3-dione hydrochloride,
CS-0051216,
Z2197092984,
3??-thia-9-azaspiro[5.5]undecane-3,3-dione hydrochloride,
3-thia-9-azaspiro[5.5]undecane-3,3-dione hydrochloride,
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| Complexity | 257 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 239.074678g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 239.76g/mol |
| Monoisotopic Mass | 239.074678g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 54.6Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
Lot Number