Basic information
- CAS
54824-08-7- Standard SMILES
O=C(c1ccccc1)C(Cl)(Cl)CO- InChIKey
TUJXSTYBXGKZOG-UHFFFAOYSA-N- Molecular formula
- C9H8Cl2O2
- Average molar mass
- 219.06 g/mol
- Monoisotopic mass
- 217.9901349
Names & identifiers
- Preferred name
- 1-Propanone, 2,2-dichloro-3-hydroxy-1-phenyl-
- IUPAC
- 2,2-dichloro-3-hydroxy-1-phenylpropan-1-one
- English name
- 1-Propanone, 2,2-dichloro-3-hydroxy-1-phenyl- (9CI)
- Molecular formula
- C9H8Cl2O2
- Molecular weight
- 219.06
Names & synonyms
1-Propanone, 2,2-dichloro-3-hydroxy-1-phenyl-54824-08-7DTXSID00341041RefChem:234880DTXCID20292122TUJXSTYBXGKZOG-UHFFFAOYSA-N2,2-dichloro-3-hydroxy-1-phenylpropan-1-oneDB-3231622,2-Dichloro-3-hydroxy-1-phenyl-1-propanone #2,2-Dichloro-3-hydroxy-1-phenyl-1-propanone1-Propanone, 2,2-dichloro-3-hydroxy-1-phenyl- (9CI)
Database identifiers
- CAS
54824-08-7- PubChem CID
- 569554
- DTXSID
DTXSID00341041- Nikkaji
- J105.410D
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 186
Chemistry & industry
Suppliers1 total
CHEMSTEP[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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