(4-Methylphenyl)sulfanylsulfone
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Basic information
- Standard SMILES
Cc1ccc(S(=O)([O-])=S)cc1- InChIKey
SSBBQNOCGGHKJQ-UHFFFAOYSA-M- Molecular formula
- C7H7O2S2-
- Average molar mass
- 187.3 g/mol
Names & identifiers
- Preferred name
- (4-Methylphenyl)sulfanylsulfone
- IUPAC
- (4-methylphenyl)-oxido-oxo-sulfanylidene-λ6-sulfane
Names & synonyms
(4-methylphenyl)sulfanylsulfoneSBB046050AKOS000275277ST45175157
Database identifiers
- PubChem CID
- 3633701
- Nikkaji
- J2.673.910A
Properties
Computed structural propertiesFilling in
- XLogP
- 3.4
- Topological polar surface area
- 80.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- -1
- Complexity
- 212
Related reactions
3 records
Compound notes
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