N-(4-bromo-2-fluorophenyl)methanesulfonamide
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Basic information
- CAS
549490-15-5- Standard SMILES
CS(=O)(=O)Nc1ccc(Br)cc1F- InChIKey
WKPHSMWPSVEOFI-UHFFFAOYSA-N- Molecular formula
- C7H7BrFNO2S
- Average molar mass
- 268.11 g/mol
- Monoisotopic mass
- 266.93649
Names & identifiers
- Preferred name
- N-(4-bromo-2-fluorophenyl)methanesulfonamide
- IUPAC
- N-(4-bromo-2-fluorophenyl)methanesulfonamide
- English name
- N-(4-bromo-2-fluorophenyl)methanesulfonamide
- Molecular formula
- C7H7BrFNO2S
- Molecular weight
- 268.1
Names & synonyms
N-(4-bromo-2-fluorophenyl)methanesulfonamide549490-15-5MFCD01342492N-(4-bromo-2-fluoro-phenyl)methanesulfonamideSCHEMBL2350815SCHEMBL30526897WKPHSMWPSVEOFI-UHFFFAOYSA-NSTL169988AKOS000185175BS-32551CS-0242655ST45145363
Show more names
Methanesulfonamide, N-(4-bromo-2-fluorophenyl)-
(4-bromo-2-fluorophenyl)(methylsulfonyl)amineG74135N-(4-Bromo-2-fluoro-phenyl)-methanesulfonamideF554114
Database identifiers
- CAS
549490-15-5- PubChem CID
- 956286
Properties
Computed structural propertiesFilling in
- XLogP
- 2.4
- Topological polar surface area
- 54.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 264
Physicochemical properties
- Boiling point
- 318.6 · 318.6±52.0 °C(Predicted)
- Density
- 1.783 · 1.783±0.06 g/cm3(Predicted)
- storage temp.
- Store at room temperature
- pka
- 7.08 · 7.08±0.10(Predicted)
- Appearance
- White to off-white Solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Related reactions
6 records
Compound notes
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