4-Bromo-N,N-dimethylbenzenesulfonamide

C8H10BrNO2SCAS 707-60-8264.14 g/mol

Open in Covalent MOL file
NSOOBr
Aryl halideSulfonamide

Properties

Molecular formula
C8H10BrNO2S
Molar mass
264.14 g/mol
Exact mass
262.9616 Da
Melting point
85–108 °C
logP
1.70Crippen estimate
Polar surface area
37.4 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
2

Hazards

Warning
Irritant (GHS07)

Aggregated from 6 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
707-60-8
SMILES
CN(C)S(=O)(=O)c1ccc(Br)cc1
InChIKey
NQAUNPZZVCXYEJ-UHFFFAOYSA-N
InChI
InChI=1S/C8H10BrNO2S/c1-10(2)13(11,12)8-5-3-7(9)4-6-8/h3-6H,1-2H3

Weigh it out

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

Names and synonyms

6 names
  • Benzenesulfonamide, 4-bromo-N,N-dimethyl-
  • Benzenesulfonamide, p-bromo-N,N-dimethyl-
  • p-Bromo-N,N-dimethylbenzenesulfonamide
  • N,N-Dimethyl-4-bromobenzenesulfonamide
  • NSC 406130
  • 4-Bromo-N,N-dimethylbenzenesulphonamide

Work with 4-Bromo-N,N-dimethylbenzenesulfonamide

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

4-Amino-N,N-dimethylbenzenesulfonamide1709-59-760 % similar 4-(N,N-Dimethylsulphonamido)benzeneboronic acid486422-59-755 % similar 1-Bromo-4-(methylsulphonyl)benzene3466-32-850 % similar 4-Bromobenzenesulfonamide701-34-845 % similar 4-Bromobenzenesulfonyl chloride98-58-845 % similar 4-Amino-3-hydroxy-N,N-dimethylbenzenesulfonamide41608-75-745 % similar N,N-Dimethylindoline-5-sulfonamide99169-99-043 % similar Potassium 4-bromobenzenesulfonate66788-58-741 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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