2,4,6-Tris(4-methoxyphenyl)-4-[4-(trifluoromethyl)phenyl]-4H-thiopyran
Basic information
- CAS
63072-28-6- Standard SMILES
COc1ccc(C2=CC(c3ccc(OC)cc3)(c3ccc(C(F)(F)F)cc3)C=C(c3ccc(OC)cc3)S2)cc1- InChIKey
WHZKFLFGLCUQPA-UHFFFAOYSA-N- Molecular formula
- C33H27F3O3S
- Average molar mass
- 560.6 g/mol
- Monoisotopic mass
- 560.16330038
Names & identifiers
- Preferred name
- 2,4,6-Tris(4-methoxyphenyl)-4-[4-(trifluoromethyl)phenyl]-4H-thiopyran
- IUPAC
- 2,4,6-tris(4-methoxyphenyl)-4-[4-(trifluoromethyl)phenyl]thiopyran
Names & synonyms
63072-28-6NSC294616DTXSID603154402,4,6-Tris(4-methoxyphenyl)-4-[4-(trifluoromethyl)phenyl]-4H-thiopyranNSC-294616
Database identifiers
- CAS
63072-28-6- PubChem CID
- 325618
- DTXSID
DTXSID60315440
Properties
Computed structural properties
- XLogP
- 8.9
- Topological polar surface area
- 53 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 7
- Heavy atoms
- 40
- Formal charge
- 0
- Complexity
- 830
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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