1-(2,3-Dichloro-phenoxy)acetone
Basic information
- CAS
15422-19-2- Standard SMILES
CC(=O)COc1cccc(Cl)c1Cl- InChIKey
XWAUACHNNLLKHN-UHFFFAOYSA-N- Molecular formula
- C9H8Cl2O2
- Average molar mass
- 219.06 g/mol
- Monoisotopic mass
- 217.9901349
Names & identifiers
- Preferred name
- 1-(2,3-Dichloro-phenoxy)acetone
- IUPAC
- 1-(2,3-dichlorophenoxy)propan-2-one
Names & synonyms
15422-19-21-(2,3-Dichloro-phenoxy)acetone1-(2,3-dichlorophenoxy)propan-2-oneNSC 211976NSC211976SCHEMBL5235490DTXSID20309441XWAUACHNNLLKHN-UHFFFAOYSA-NAKOS008905641NSC-211976
Database identifiers
- CAS
15422-19-2- PubChem CID
- 309646
- DTXSID
DTXSID20309441
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 184
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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