Basic information
- Standard SMILES
Cc1cc(S(=O)(=O)O)c([N+](=O)[O-])cc1F- InChIKey
JQUSVAOTDSJJOV-UHFFFAOYSA-N- Molecular formula
- C7H6FNO5S
- Average molar mass
- 235.19 g/mol
Names & identifiers
- Preferred name
- 4-Fluoro-5-methyl-2-nitro-benzenesulfonic acid
- IUPAC
- 4-fluoro-5-methyl-2-nitrobenzenesulfonic acid
Names & synonyms
SCHEMBL11973321JQUSVAOTDSJJOV-UHFFFAOYSA-N4-Fluoro-5-methyl-2-nitro-benzenesulfonic acid
Database identifiers
- PubChem CID
- 86669766
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 109 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 345
Related reactions
2 records
Compound notes
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