1H-Isoindole-1,3(2H)-dione, 2-(2-acetylphenyl)-4-nitro-
Basic information
- CAS
143583-67-9- Standard SMILES
CC(=O)c1ccccc1N1C(=O)c2cccc([N+](=O)[O-])c2C1=O- InChIKey
BNHMEMWKGXIWGO-UHFFFAOYSA-N- Molecular formula
- C16H10N2O5
- Average molar mass
- 310.26 g/mol
- Monoisotopic mass
- 310.05897142
Names & identifiers
- Preferred name
- 1H-Isoindole-1,3(2H)-dione, 2-(2-acetylphenyl)-4-nitro-
- IUPAC
- 2-(2-acetylphenyl)-4-nitroisoindole-1,3-dione
Names & synonyms
1H-Isoindole-1,3(2H)-dione, 2-(2-acetylphenyl)-4-nitro-143583-67-9DTXSID80353920RefChem:239307DTXCID903049832-(2-acetylphenyl)-4-nitroisoindole-1,3-dione2-(2-acetylphenyl)-4-nitro-1H-isoindole-1,3(2H)-dioneAKOS001704994EU-0084220SR-01000510698SR-01000510698-1
Database identifiers
- CAS
143583-67-9- PubChem CID
- 758975
- DTXSID
DTXSID80353920
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 100 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 555
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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