| CAS Number | 849770-44-1 |
| Catalog Number | AG00GACL(AGN-PC-02XB0R) |
| Chemical Name | 1,5-Dimethylpyrrolidine-2,4-dione |
| IUPAC Name | 1,5-dimethylpyrrolidine-2,4-dione |
| InChI | InChI=1S/C6H9NO2/c1-4-5(8)3-6(9)7(4)2/h4H,3H2,1-2H3 |
| InChI Key | PZQPWDZFFADFKJ-UHFFFAOYSA-N |
| MDL Number | MFCD19690648 |
| Molecular Formula | C6H9NO2 |
| Molecular Weight | 127.1412 |
| SMILES | CC1C(=O)CC(=O)N1C |
| Synonyms | 1,5-Dimethylpyrrolidine-2,4-dione,
849770-44-1,
1,5-DIMETHYL-2,4-PYRROLIDINEDIONE,
SCHEMBL5977661,
MFCD19690648,
AS-41158,
|
| Complexity | 164 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 127.063g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 127.143g/mol |
| Monoisotopic Mass | 127.063g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 37.4A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.1 |
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Lot Number