Basic information
- CAS
35843-60-8- Standard SMILES
O=C1c2ccccc2C(=O)N1c1ccc([N+](=O)[O-])cc1[N+](=O)[O-]- InChIKey
YZSSEYTUQPHWFK-UHFFFAOYSA-N- Molecular formula
- C14H7N3O6
- Average molar mass
- 313.22 g/mol
- Monoisotopic mass
- 313.03348495
Names & identifiers
- Preferred name
- 1H-Isoindole-1,3(2H)-dione, 2-(2,4-dinitrophenyl)-
- IUPAC
- 2-(2,4-dinitrophenyl)isoindole-1,3-dione
Names & synonyms
35843-60-81H-Isoindole-1,3(2H)-dione, 2-(2,4-dinitrophenyl)-2-(2,4-Dinitrophenyl)-1H-isoindole-1,3(2H)-dioneDTXSID40189388RefChem:239291DTXCID701118792-(2,4-dinitrophenyl)isoindole-1,3-dioneMFCD006265442-(2,4-Dinitro-phenyl)-isoindole-1,3-dionen-(2,4-dinitrophenyl)phthalimideYZSSEYTUQPHWFK-UHFFFAOYSA-NAKOS000531073
Show more names
SR-01000319397SR-01000319397-12-(2,4-Dinitrophenyl)-1H-isoindole-1,3(2H)-dione #
Database identifiers
- CAS
35843-60-8- PubChem CID
- 596145
- DTXSID
DTXSID40189388
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 129 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 1
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 530
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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