| CAS Number | 212710-51-5 |
| Catalog Number | AG00I438 |
| Chemical Name | 7-Thia-1,3-diazaspiro[4.4]nonane-2,4-dione |
| IUPAC Name | 7-thia-1,3-diazaspiro[4.4]nonane-2,4-dione |
| InChI | InChI=1S/C6H8N2O2S/c9-4-6(1-2-11-3-6)8-5(10)7-4/h1-3H2,(H2,7,8,9,10) |
| InChI Key | MDNCSTBDLRSGIJ-UHFFFAOYSA-N |
| MDL Number | MFCD06363493 |
| Molecular Formula | C6H8N2O2S |
| Molecular Weight | 172.2049 |
| SMILES | O=C1NC2(CSCC2)C(=O)N1 |
| Synonyms | 7-thia-1,3-diazaspiro[4.4]nonane-2,4-dione,
212710-51-5,
AC1NJ8LG,
AC1Q6G69,
CTK7H5602,
MFCD06363493,
AKOS000117367,
AKOS017269120,
MCULE-3284305546,
NE41839,
AS-45003,
EN300-10938,
3-thia-7,9-diazaspiro[4.4]nonane-6,8-dione,
Z57042025,
ZINC03434819,
CID4868343,
|
| Complexity | 231 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 172.031g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 172.202g/mol |
| Monoisotopic Mass | 172.031g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 83.5A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number