4-Chloro-3-[chloro(difluoro)methyl]-4,4-difluoro-3-hydroxy-2-methyl-1-phenylbutan-1-one
Basic information
- CAS
34844-20-7- Standard SMILES
CC(C(=O)c1ccccc1)C(O)(C(F)(F)Cl)C(F)(F)Cl- InChIKey
WMTRZNHXXJKFTP-UHFFFAOYSA-N- Molecular formula
- C12H10Cl2F4O2
- Average molar mass
- 333.1 g/mol
- Monoisotopic mass
- 331.9993976
Names & identifiers
- Preferred name
- 4-Chloro-3-[chloro(difluoro)methyl]-4,4-difluoro-3-hydroxy-2-methyl-1-phenylbutan-1-one
- IUPAC
- 4-chloro-3-[chloro(difluoro)methyl]-4,4-difluoro-3-hydroxy-2-methyl-1-phenylbutan-1-one
Names & synonyms
34844-20-74-chloro-3-[chloro(difluoro)methyl]-4,4-difluoro-3-hydroxy-2-methyl-1-phenylbutan-1-oneNSC162155DTXSID20303803NSC-1621554-Chloro-3-[chlorodi(fluoro)methyl]-4,4-difluoro-3-hydroxy-2-methyl-1-phenylbutan-1-one
Database identifiers
- CAS
34844-20-7- PubChem CID
- 294165
- DTXSID
DTXSID20303803
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 356
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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