4-Hydroxybenzenesulfonamide

C₆H₇NO₃SCAS 1576-43-8173.19 g/mol

Open in Covalent MOL file

Phenol Sulfonamide

Properties

Molecular formula: C₆H₇NO₃S
Molar mass: 173.19 g/mol
Exact mass: 173.0147 Da
Melting point: 178 °C
logP: 0.04Crippen estimate
Polar surface area: 80.4 Å²
H-bond donors / acceptors: 2 / 3
Rotatable bonds: 1

Hazards

Warning

H302 Harmful if swallowed50% of notifiers
H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H335 May cause respiratory irritation75% of notifiers

Aggregated from 4 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

1576-43-8

SMILES

NS(=O)(=O)c1ccc(O)cc1

InChIKey

DIRCLGLKRZLKHG-UHFFFAOYSA-N

InChI

InChI=1S/C6H7NO3S/c7-11(9,10)6-3-1-5(8)2-4-6/h1-4,8H,(H2,7,9,10)

Weigh it out

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

Names and synonyms

8 names

Benzenesulfonamide, 4-hydroxy-
Benzenesulfonamide, p-hydroxy-
1-Phenol-4-sulfonamide
p-Hydroxybenzenesulfonamide
4-Sulfamoylphenol
p-Phenolsulfonamide
NSC 20848
4-Hydroxybenzene-1-sulfonamide

Work with 4-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-Bromobenzenesulfonamide701-34-862 % similar Sulfanilamide63-74-158 % similar Bisphenol S80-09-156 % similar Benzenesulfonamide98-10-256 % similar 4-Fluorobenzenesulfonamide402-46-056 % similar P-Toluenesulfonamide70-55-356 % similar 4-Chlorobenzenesulfonamide98-64-656 % similar 4-(Aminosulfonyl)phenylboronic acid613660-87-055 % similar

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

Same formula

Metanilic acid121-47-1 Sulfanilic acid121-57-3 Piloty's acid599-71-3 Orthanilic acid88-21-1

Elsewhere

PubChem CAS Common Chemistry NIST WebBook