Basic information
- CAS
6947-57-5- Standard SMILES
O=S(=O)(c1ccccc1)C1CCCCC1- InChIKey
GCNSHAQTYKVLHX-UHFFFAOYSA-N- Molecular formula
- C12H16O2S
- Average molar mass
- 224.32 g/mol
- Monoisotopic mass
- 224.08710092
Overview
See also: Cyclohexyl phenyl sulfone (annotation moved to).
Names & identifiers
- Preferred name
- (Cyclohexanesulfonyl)benzene
- IUPAC
- cyclohexylsulfonylbenzene
Names & synonyms
(cyclohexanesulfonyl)benzene6947-57-5(cyclohexylsulfonyl)benzenecyclohexylsulfonylbenzeneNSC56972Cyclohexanesulfonyl-benzeneSCHEMBL776895SCHEMBL27891264DTXSID80989405GAA94757NSC-56972AKOS000279681
Show more names
CS-0234064EN300-138467
Database identifiers
- CAS
6947-57-5- PubChem CID
- 245250
- DTXSID
DTXSID80989405- Nikkaji
- J746.801F
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 42.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 277
Experimental & physicochemical properties
SpringerMaterials PropertiesChemical shift
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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