chempirical

4-Amino-2-chloro-5-hydroxybenzenesulfonamide

C6H7ClN2O3SCAS 41606-65-9222.64 g/mol

Open in Covalent MOL file
H2NClSNH2OOHO
Aryl halidePhenolPrimary amineSulfonamide

Properties

Molecular formula
C6H7ClN2O3S
Molar mass
222.64 g/mol
Exact mass
221.9866 Da
logP
0.28Crippen estimate
Polar surface area
106.4 Ų
H-bond donors / acceptors
3 / 4
Rotatable bonds
1

Identifiers

CAS number
41606-65-9
SMILES
Nc1cc(Cl)c(S(N)(=O)=O)cc1O
InChIKey
WUDOEWHXJCBYJH-UHFFFAOYSA-N
InChI
InChI=1S/C6H7ClN2O3S/c7-3-1-4(8)5(10)2-6(3)13(9,11)12/h1-2,10H,8H2,(H2,9,11,12)

Weigh it out

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

Names and synonyms

4 names
  • Benzenesulfonamide, 4-amino-2-chloro-5-hydroxy-
  • 1-Phenol-3-sulfonamide, 6-amino-4-chloro-
  • 2-Aminophenol-4-chloro-5-sulfonamide
  • 2-Amino-4-chloro-5-sulfamoylphenol

Work with 4-Amino-2-chloro-5-hydroxybenzenesulfonamide

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-6-chloro-1,3-benzenedisulfonamide121-30-270 % similar 5-(Aminosulfonyl)-4-chloro-2-hydroxybenzoic acid14556-98-055 % similar 4-Amino-2-chloro-5-(2H-tetrazol-5-yl)benzenesulfonamide82212-14-450 % similar 2-Aminophenol-4-sulfonamide98-32-850 % similar 5-(Aminosulfonyl)-2,4-dichlorobenzoic acid2736-23-448 % similar 2-Chlorobenzenesulfonamide6961-82-647 % similar 4-Amino-2,5-dichlorobenzenesulfonic acid88-50-646 % similar 2-Amino-4-chloro-5-nitrophenol6358-07-245 % similar

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

Elsewhere

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