Sulfonyldi(4,1-phenylene) diacetate
Basic information
- CAS
5456-51-9- Standard SMILES
CC(=O)Oc1ccc(S(=O)(=O)c2ccc(OC(C)=O)cc2)cc1- InChIKey
UVSACKAENHNCEZ-UHFFFAOYSA-N- Molecular formula
- C16H14O6S
- Average molar mass
- 334.3 g/mol
- Monoisotopic mass
- 334.05110934
Names & identifiers
- Preferred name
- Sulfonyldi(4,1-phenylene) diacetate
- IUPAC
- [4-(4-acetyloxyphenyl)sulfonylphenyl] acetate
- English name
- 4,4'-Sulfonylbis(phenol)diacetate
- Molecular weight
- 0
Names & synonyms
5456-51-9NSC689434NSC21515MLS0010335124,4'-DiacetoxydiphenylsulfoneCHEMBL219778SCHEMBL9343618DTXSID00281397UVSACKAENHNCEZ-UHFFFAOYSA-NHMS1730E04HMS2729E04NSC-21515
Show more names
Bis(p-acetoxyphenyl) sulfone4,4'-Sulfonylbis(phenol)diacetateDiacetic acid sulfonylbis-p-phenylene ester
Sulfonyldi(4,1-phenylene) diacetateSulfonylbis(4,1-phenylene) diacetateAKOS001094737NSC-68943480-09-1, AcSMR000385623[4-(4-acetoxyphenyl)sulfonylphenyl] acetateZ30863781
Database identifiers
- CAS
5456-51-9- PubChem CID
- 228533
- DTXSID
DTXSID00281397- ChEMBL
CHEMBL219778- Nikkaji
- J31.787J
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 95.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 477
Experimental & physicochemical properties
SpringerMaterials PropertiesChemical shift
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Related reactions
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Compound notes
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