Basic information
- CAS
113342-93-1- Standard SMILES
O=[N+]([O-])c1ccc(N2CC=CC2)cc1- InChIKey
ONKPTHWLKJUENM-UHFFFAOYSA-N- Molecular formula
- C10H10N2O2
- Average molar mass
- 190.2 g/mol
- Monoisotopic mass
- 190.07422757
Names & identifiers
- Preferred name
- 1-(4-Nitrophenyl)-2,5-dihydro-1H-pyrrole
- IUPAC
- 1-(4-nitrophenyl)-2,5-dihydropyrrole
Names & synonyms
113342-93-11-(4-Nitrophenyl)-2,5-dihydro-1H-pyrrole1H-Pyrrole, 2,5-dihydro-1-(4-nitrophenyl)-DTXSID00549909AKOS006308854
Database identifiers
- CAS
113342-93-1- PubChem CID
- 13802440
- DTXSID
DTXSID00549909
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 49.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 231
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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