Basic information
- CAS
34277-83-3- Standard SMILES
Cc1ccc(CS(=O)(=O)Cc2ccc(C)c(C)c2)cc1C- InChIKey
MFEDSGWROYASKV-UHFFFAOYSA-N- Molecular formula
- C18H22O2S
- Average molar mass
- 302.4 g/mol
- Monoisotopic mass
- 302.13405111
Names & identifiers
- Preferred name
- Bis(3,4-dimethylbenzyl)sulfone
- IUPAC
- 4-[(3,4-dimethylphenyl)methylsulfonylmethyl]-1,2-dimethylbenzene
Names & synonyms
Bis[3,4-dimethylbenzyl]sulfoneDTXSID7090503834277-83-3Bis(3,4-dimethylbenzyl)sulfoneRefChem:329682DTXCID501334142MFEDSGWROYASKV-UHFFFAOYSA-NSCHEMBL213917521,1'-[Sulfonylbis(methylene)]bis(3,4-dimethylbenzene)4-([(3,4-Dimethylbenzyl)sulfonyl]methyl)-1,2-dimethylbenzene #
Database identifiers
- CAS
34277-83-3- PubChem CID
- 577308
- DTXSID
DTXSID70905038
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 42.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 389
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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