Basic information
- Standard SMILES
CCCN1CCc2cc([N+](=O)[O-])ccc21- InChIKey
QJBYQCKFQWLENS-UHFFFAOYSA-N- Molecular formula
- C11H14N2O2
- Average molar mass
- 206.24 g/mol
Names & identifiers
- Preferred name
- 5-Nitro-1-propylindoline
- IUPAC
- 5-nitro-1-propyl-2,3-dihydroindole
Names & synonyms
5-nitro-1-propylindolineSCHEMBL5678082QJBYQCKFQWLENS-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 9834276
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 49.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 239
Related reactions
2 records
Compound notes
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