2,2'-[Sulfonylbis(methylene)]bis(4,6-dimethylphenol)
Basic information
- CAS
63261-28-9- Standard SMILES
Cc1cc(C)c(O)c(CS(=O)(=O)Cc2cc(C)cc(C)c2O)c1- InChIKey
BFKKBHXWUBYAEB-UHFFFAOYSA-N- Molecular formula
- C18H22O4S
- Average molar mass
- 334.4 g/mol
- Monoisotopic mass
- 334.12388035
Names & identifiers
- Preferred name
- 2,2'-[Sulfonylbis(methylene)]bis(4,6-dimethylphenol)
- IUPAC
- 2-[(2-hydroxy-3,5-dimethylphenyl)methylsulfonylmethyl]-4,6-dimethylphenol
Names & synonyms
NSC-28088063261-28-9NSC280880CHEMBL1814534DTXSID20314156DS-0126762,2'-[Sulfonylbis(methylene)]bis(4,6-dimethylphenol)2-[(2-Hydroxy-3,5-dimethyl-phenyl)methylsulfonylmethyl]-4,6-dimethyl-phenol
Database identifiers
- CAS
63261-28-9- PubChem CID
- 322757
- DTXSID
DTXSID20314156- ChEMBL
CHEMBL1814534
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 83 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 446
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…