Basic information
- CAS
51347-05-8- Standard SMILES
O=S(=O)(Cc1ccccc1)C(=C(c1ccccc1)c1ccccc1)c1ccccc1- InChIKey
GELCKJMFSAGHOF-UHFFFAOYSA-N- Molecular formula
- C27H22O2S
- Average molar mass
- 410.5 g/mol
- Monoisotopic mass
- 410.13405111
Names & identifiers
- Preferred name
- 1,1',1''-[2-(Benzylsulfonyl)ethene-1,1,2-triyl]tribenzene
- IUPAC
- 1,2,2-triphenylethenylsulfonylmethylbenzene
Names & synonyms
51347-05-81,1',1''-[2-(benzylsulfonyl)ethene-1,1,2-triyl]tribenzeneNSC137608DTXSID80300575NSC-1376081,1',1''-[2-(Phenylmethanesulfonyl)ethene-1,1,2-triyl]tribenzene
Database identifiers
- CAS
51347-05-8- PubChem CID
- 283237
- DTXSID
DTXSID80300575
Properties
Computed structural properties
- XLogP
- 6.6
- Topological polar surface area
- 42.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 627
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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