Basic information
- Standard SMILES
Cn1cc(Br)c2ccc(S(=O)(=O)Oc3c(F)c(F)c(F)c(F)c3F)cc21- InChIKey
LPVGEBYOUPHUOX-UHFFFAOYSA-N- Molecular formula
- C15H7BrF5NO3S
- Average molar mass
- 456.2 g/mol
Names & identifiers
- Preferred name
- perfluorophenyl 3-bromo-1-methyl-1H-indole-6-sulfonate
- IUPAC
- (2,3,4,5,6-pentafluorophenyl) 3-bromo-1-methylindole-6-sulfonate
Names & synonyms
SCHEMBL14698989LPVGEBYOUPHUOX-UHFFFAOYSA-Nperfluorophenyl 3-bromo-1-methyl-1H-indole-6-sulfonate
Database identifiers
- PubChem CID
- 89407702
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 56.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 3
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 607
Related reactions
3 records
Compound notes
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