Basic information
- CAS
4583-50-0- Standard SMILES
O=C(c1ccccc1)N1C(=O)c2ccccc2C1=O- InChIKey
SDZZWFIVMZCSIB-UHFFFAOYSA-N- Molecular formula
- C15H9NO3
- Average molar mass
- 251.24 g/mol
- Monoisotopic mass
- 251.05824315
Names & identifiers
- Preferred name
- 2-Benzoyl-1H-isoindole-1,3(2H)-dione
- IUPAC
- 2-benzoylisoindole-1,3-dione
- English name
- N-Benzoylphthalimide
- Molecular formula
- C15H9NO3
- Molecular weight
- 251.24
Names & synonyms
4583-50-01H-Isoindole-1,3(2H)-dione, 2-benzoyl-DTXSID701966262-Benzoyl-1H-isoindole-1,3(2H)-dioneRefChem:1062377DTXCID10119117N-BenzoylphthalimidePhthalimide, N-benzoyl-2-benzoylisoindole-1,3-dioneNSC 137566BRN 0199407phthaloyl benzamide
Show more names
2-Benzoyl-2H-isoindole-1,3-dione
NSC137566Oprea1_769831Oprea1_7989831H-Isoindole-1,3(2H)-dione, 2-benzoyl- (9CI)5-21-10-00427 (Beilstein Handbook Reference)WLN: T56 BVNVJ CVR1H-Isoindole-1, 2-benzoyl-SCHEMBL9686147
Database identifiers
- CAS
4583-50-0- PubChem CID
- 97623
- DTXSID
DTXSID70196626- Nikkaji
- J50.513G
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 54.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 388
Physicochemical properties
- Melting point
- 168 °C · 168 °C
- Boiling point
- 432.2 · 432.2±28.0 °C(Predicted)
- Density
- 1.398 · 1.398±0.06 g/cm3(Predicted)
- pka
- -3.04 · -3.04±0.20(Predicted)
Chemistry & industry
Suppliers1 total
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Related reactions
0 records
No reaction records under the current filter.
Compound notes
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