Basic information
- CAS
18167-28-7- Standard SMILES
COc1ccc(NC(=O)c2ccc(S(=O)(=O)F)cc2)cc1- InChIKey
OTKWKQUEVRRRQJ-UHFFFAOYSA-N- Molecular formula
- C14H12FNO4S
- Average molar mass
- 309.31 g/mol
- Monoisotopic mass
- 309.0471072
Names & identifiers
- Preferred name
- 4-[(4-Methoxyphenyl)carbamoyl]benzenesulfonyl fluoride
- IUPAC
- 4-[(4-methoxyphenyl)carbamoyl]benzenesulfonyl fluoride
Names & synonyms
18167-28-74-[(4-methoxyphenyl)carbamoyl]benzenesulfonyl fluorideNSC211760DTXSID00309323NSC-2117604-[(4-Methoxyphenyl)carbamoyl]benzene-1-sulfonyl fluoride
Database identifiers
- CAS
18167-28-7- PubChem CID
- 309477
- DTXSID
DTXSID00309323
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 80.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 446
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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