2-(2,5-Dioxo-1-phenyl-3-pyrrolidinyl)-1H-isoindole-1,3(2H)-dione
Basic information
- CAS
52604-93-0- Standard SMILES
O=C1CC(N2C(=O)c3ccccc3C2=O)C(=O)N1c1ccccc1- InChIKey
KLUHCMRNGZPHJG-UHFFFAOYSA-N- Molecular formula
- C18H12N2O4
- Average molar mass
- 320.3 g/mol
- Monoisotopic mass
- 320.07970687
Names & identifiers
- Preferred name
- 2-(2,5-Dioxo-1-phenyl-3-pyrrolidinyl)-1H-isoindole-1,3(2H)-dione
- IUPAC
- 2-(2,5-dioxo-1-phenylpyrrolidin-3-yl)isoindole-1,3-dione
Names & synonyms
52604-93-02-(2,5-Dioxo-1-phenyl-3-pyrrolidinyl)-1H-isoindole-1,3(2H)-dione1H-ISOINDOLE-1,3(2H)-DIONE, 2-(2,5-DIOXO-1-PHENYL-3-PYRROLIDINYL)-RefChem:1060767Phthalimide, N-(2,5-dioxo-1-phenyl-3-pyrrolidinyl)-BRN 0040763N(sup 2)-Phthaloyl-N-phenylaspartimide5-22-13-00214 (Beilstein Handbook Reference)DTXSID509670332-(2,5-dioxo-1-phenylpyrrolidin-3-yl)-1H-isoindole-1,3(2H)-dione
Database identifiers
- CAS
52604-93-0- PubChem CID
- 40453
- DTXSID
DTXSID50967033
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 74.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 572
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Compound notes
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