Basic information
- Standard SMILES
Cl.Nc1ccccc1C(=O)CCCCl- InChIKey
SUYDUAIIHIGTOF-UHFFFAOYSA-N- Molecular formula
- C10H13Cl2NO
- Average molar mass
- 234.12 g/mol
Names & identifiers
- Preferred name
- 1-(o-Aminophenyl)-4-chloro-1-butanone hydrochloride
- IUPAC
- 1-(2-aminophenyl)-4-chlorobutan-1-one;hydrochloride
Names & synonyms
SCHEMBL7799850SUYDUAIIHIGTOF-UHFFFAOYSA-N1-(2-aminophenyl)-4-chlorobutan-1-one hydrochloride1-(o-aminophenyl)-4-chloro-1-butanone hydrochloride
Database identifiers
- PubChem CID
- 23293246
Properties
Computed structural properties
- Topological polar surface area
- 43.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 172
Related reactions
4 records
Compound notes
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