| CAS Number | 54433-49-7 |
| Catalog Number | AG01DX8I(AGN-PC-0NJI4C) |
| Chemical Name | 1H-Pyrrole-2,5-dione, 1-methyl-3-phenyl- |
| IUPAC Name | 1-methyl-3-phenylpyrrole-2,5-dione |
| InChI | InChI=1S/C11H9NO2/c1-12-10(13)7-9(11(12)14)8-5-3-2-4-6-8/h2-7H,1H3 |
| InChI Key | IYBPIDAYDPNCTP-UHFFFAOYSA-N |
| MDL Number | MFCD27925151 |
| Molecular Formula | C11H9NO2 |
| Molecular Weight | 187.1947 |
| SMILES | CN1C(=O)C=C(C1=O)c1ccccc1 |
| Synonyms | 1H-Pyrrole-2,5-dione, 1-methyl-3-phenyl-,
54433-49-7,
N-Methyl-2-phenylmaleimide,
SCHEMBL149927,
CHEMBL476050,
CTK1F8895,
DTXSID00503420,
1-Methyl-3-phenyl-1H-pyrrole-2,5-dione,
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| Complexity | 300 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 187.063g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 187.198g/mol |
| Monoisotopic Mass | 187.063g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 37.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.1 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number