2-[(3S)-2,5-Dioxooxolan-3-YL]isoindole-1,3-dione

Base Information

• Chemical Name: 2-[(3S)-2,5-Dioxooxolan-3-YL]isoindole-1,3-dione
• CAS No.: 16652-95-2
• Molecular Formula: C12H7NO5
• Molecular Weight: 245.191
• ChEMBL ID: CHEMBL4944109
• DSSTox Substance ID: DTXSID90467305
• Nikkaji Number: J1.090.383A
• Wikidata: Q82294185
• Mol file: 16652-95-2.mol

Synonyms:CHEMBL4944109;SCHEMBL11606116;DTXSID90467305;16652-95-2;2-[(3S)-2,5-DIOXOOXOLAN-3-YL]ISOINDOLE-1,3-DIONE

Chemical Property of 2-[(3S)-2,5-Dioxooxolan-3-YL]isoindole-1,3-dione

Chemical Property:

• XLogP3: 0.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 1
• Exact Mass: 245.03242232
• Heavy Atom Count: 18
• Complexity: 433

Purity/Quality:

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MSDS Files:

Useful:

• Canonical SMILES: C1C(C(=O)OC1=O)N2C(=O)C3=CC=CC=C3C2=O
• Isomeric SMILES: C1[C@@H](C(=O)OC1=O)N2C(=O)C3=CC=CC=C3C2=O

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