| CAS Number | 501357-88-6 |
| Catalog Number | AG019KDG |
| Chemical Name | 3,3-Diethylpyrrolidine-2,5-dione |
| IUPAC Name | 3,3-diethylpyrrolidine-2,5-dione |
| InChI | InChI=1S/C8H13NO2/c1-3-8(4-2)5-6(10)9-7(8)11/h3-5H2,1-2H3,(H,9,10,11) |
| InChI Key | CDTVXZXPNNELFC-UHFFFAOYSA-N |
| MDL Number | MFCD08691355 |
| Molecular Formula | C8H13NO2 |
| Molecular Weight | 155.1943 |
| NSC Number | 9420 |
| SMILES | CCC1(C(=O)NC(=O)C1)CC |
| Synonyms | 3,3-diethylpyrrolidine-2,5-dione,
501357-88-6,
NSC9420,
AC1Q2SP7,
AC1L5C07,
SCHEMBL3706662,
CTK6D0171,
NSC-9420,
ZINC1699977,
AKOS009106671,
NE14013,
EN300-26471,
CID222690,
|
| Complexity | 194 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 155.095g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 155.197g/mol |
| Monoisotopic Mass | 155.095g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 46.2A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number