1-(3-Chloroanilino)propan-2-ol
Basic information
- CAS
111609-82-6- Standard SMILES
CC(O)CNc1cccc(Cl)c1- InChIKey
IKEBQDAAZBVUBX-UHFFFAOYSA-N- Molecular formula
- C9H12ClNO
- Average molar mass
- 185.65 g/mol
- Monoisotopic mass
- 185.0607417
Names & identifiers
- Preferred name
- 1-(3-Chloroanilino)propan-2-ol
- IUPAC
- 1-(3-chloroanilino)propan-2-ol
Names & synonyms
1-(3-Chloroanilino)propan-2-ol111609-82-6SCHEMBL11750105DTXSID90613502
Database identifiers
- CAS
111609-82-6- PubChem CID
- 21418966
- DTXSID
DTXSID90613502
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 32.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 132
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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