1-(Benzenesulfinyl)-4-bromobenzene
Basic information
- CAS
25186-92-9- Standard SMILES
O=S(c1ccccc1)c1ccc(Br)cc1- InChIKey
ZTRXUNUYTUUDRR-UHFFFAOYSA-N- Molecular formula
- C12H9BrOS
- Average molar mass
- 281.17 g/mol
- Monoisotopic mass
- 279.95575
Names & identifiers
- Preferred name
- 1-(Benzenesulfinyl)-4-bromobenzene
- IUPAC
- 1-(benzenesulfinyl)-4-bromobenzene
- English name
- Phenyl 4-bromophenyl sulfoxide
- Molecular formula
- C12H9BrOS
- Molecular weight
- 281.17
Names & synonyms
1-(benzenesulfinyl)-4-bromobenzene25186-92-9DTXSID30948042RefChem:1054585DTXCID901376287p-Bromophenyl phenyl sulfoxide4-Bromodiphenyl sulfoxideSulfoxide, p-bromophenyl phenyl1-bromo-4-(phenylsulfinyl)benzeneBRN 4247696SCHEMBL9316559p-Bromophenylphenyl sulfoxide
Show more names
Phenyl 4-bromophenyl sulfoxidePhenyl(4-bromophenyl) sulfoxide(p-Bromophenyl)phenyl sulfoxideBenzene, 1-bromo-4-(phenylsulfinyl)-
Database identifiers
- CAS
25186-92-9- PubChem CID
- 212855
- DTXSID
DTXSID30948042- Nikkaji
- J48.760K
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 36.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 218
Experimental & physicochemical properties
SpringerMaterials Properties13C nuclear magnetic resonance spectrum
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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