Basic information
- Standard SMILES
O=S(=O)(CCO)c1ccc(Oc2ccc(S)cc2)cc1- InChIKey
VZYKTVOJVIBSJZ-UHFFFAOYSA-N- Molecular formula
- C14H14O4S2
- Average molar mass
- 310.4 g/mol
- Monoisotopic mass
- 310.03335127
Names & identifiers
- Preferred name
- 4-(4'-beta-Hydroxyethylsulfonylphenoxy)thiophenol
- IUPAC
- 2-[4-(4-sulfanylphenoxy)phenyl]sulfonylethanol
Names & synonyms
SCHEMBL9168670VZYKTVOJVIBSJZ-UHFFFAOYSA-N4-(4'-beta-hydroxyethylsulfonylphenoxy)thiophenol
Database identifiers
- PubChem CID
- 19737697
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 73 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 374
Related reactions
4 records
Compound notes
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