| CAS Number | 5699-91-2 |
| Catalog Number | AG00ESRD(AGN-PC-0LWTOK) |
| Chemical Name | 1,4-Diazaspiro[5.5]undecane-3,5-dione |
| IUPAC Name | 1,4-diazaspiro[5.5]undecane-3,5-dione |
| InChI | InChI=1S/C9H14N2O2/c12-7-6-10-9(8(13)11-7)4-2-1-3-5-9/h10H,1-6H2,(H,11,12,13) |
| InChI Key | ZQIMXZJALAYSTB-UHFFFAOYSA-N |
| MDL Number | MFCD07688003 |
| Molecular Formula | C9H14N2O2 |
| Molecular Weight | 182.2197 |
| SMILES | O=C1NC(=O)C2(CCCCC2)NC1 |
| Synonyms | 1,4-diazaspiro[5.5]undecane-3,5-dione,
5699-91-2,
AC1OFLPI,
AC1Q6ETQ,
CTK5A6129,
DTXSID90427929,
MFCD07688003,
ZINC57211595,
AKOS009047514,
NE13693,
2,5-diazaspiro[5.5]undecane-1,3-quinone,
8,11-diazaspiro[5.5]undecane-7,9-dione,
EN300-15332,
CID7131553,
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| Complexity | 244 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 182.106g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 182.223g/mol |
| Monoisotopic Mass | 182.106g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 58.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.3 |
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Certificate of Analysis
Lot Number