chempirical

3-Fluorobenzenesulfonamide

C6H6FNO2SCAS 1524-40-9175.18 g/mol

Open in Covalent MOL file
SOONH2F
Aryl halideSulfonamide

Properties

Molecular formula
C6H6FNO2S
Molar mass
175.18 g/mol
Exact mass
175.0103 Da
logP
0.47Crippen estimate
Polar surface area
60.2 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
1

Identifiers

CAS number
1524-40-9
SMILES
C1=CC(=CC(=C1)S(=O)(=O)N)F
InChIKey
CRINBBOGNYCAOV-UHFFFAOYSA-N
InChI
InChI=1S/C6H6FNO2S/c7-5-2-1-3-6(4-5)11(8,9)10/h1-4H,(H2,8,9,10)

Weigh it out

Type any one amount. The others follow from the molar mass.

Work with 3-Fluorobenzenesulfonamide

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

3-Aminobenzenesulfonamide98-18-060 % similar Benzenesulfonamide98-10-256 % similar 2,5-Difluorobenzenesulfonamide120022-63-152 % similar 3-Nitrobenzenesulfonamide121-52-850 % similar 3,5-Dichlorobenzenesulfonamide19797-32-145 % similar 4-Chlorobenzenesulfonamide98-64-645 % similar 1,3-Difluorobenzene372-18-944 % similar Carbonic anhydrase ix/xii inhibitor ii(U-104)178606-66-144 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Fluoromethyl 2-pyridyl sulfone1365765-53-2 4-Fluorobenzenesulfonamide402-46-0

Elsewhere

PubChem CAS Common Chemistry NIST WebBook