| CAS Number | 1337926-15-4 |
| Catalog Number | AG01A0K0(AGN-PC-0WO5QC) |
| Chemical Name | 2-(3,3-dimethyl-2,5-dioxopyrrolidin-1-yl)acetic acid |
| IUPAC Name | 2-(3,3-dimethyl-2,5-dioxopyrrolidin-1-yl)acetic acid |
| InChI | InChI=1S/C8H11NO4/c1-8(2)3-5(10)9(7(8)13)4-6(11)12/h3-4H2,1-2H3,(H,11,12) |
| InChI Key | CRQUSJPUMBMFTN-UHFFFAOYSA-N |
| MDL Number | MFCD21187182 |
| Molecular Formula | C8H11NO4 |
| Molecular Weight | 185.1772 |
| SMILES | CC1(C(=O)N(CC(O)=O)C(=O)C1)C |
| Synonyms | 2-(3,3-dimethyl-2,5-dioxopyrrolidin-1-yl)acetic acid,
1337926-15-4,
ZINC78210783,
AKOS014633164,
MCULE-1909357187,
NE51085,
Z1695906885,
|
| Complexity | 282 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 185.069g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 185.179g/mol |
| Monoisotopic Mass | 185.069g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 74.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.3 |
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Certificate of Analysis
Lot Number