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3-amino-5-(aminosulphonyl)-4-phenoxybenzoic acid

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3-amino-5-(aminosulphonyl)-4-phenoxybenzoic acid Basic information
Product Name:3-amino-5-(aminosulphonyl)-4-phenoxybenzoic acid
Synonyms:BuMetanide related coMpound A (Desbutyl);3-amino-5-(aminosulphonyl)-4-phenoxybenzoic acid;BUTMETANIDERELATEDA;Desbutyl Bumetanide;Desbutylbumetanide;PF 1578;Benzoic acid,3-aMino-5-(aMinosulfonyl)-4-phenoxy;USP Bumetanide Related Compound A, Bumetanide impurity B (EP)
CAS:28328-54-3
MF:C13H12N2O5S
MW:308.31
EINECS:248-971-1
Product Categories:Chemical Amines;Amines;Intermediates & Fine Chemicals;Metabolites & Impurities;Pharmaceuticals;Sulfur & Selenium Compounds
Mol File:28328-54-3.mol
3-amino-5-(aminosulphonyl)-4-phenoxybenzoic acid Structure
3-amino-5-(aminosulphonyl)-4-phenoxybenzoic acid Chemical Properties
Melting point 250-256°C
Boiling point 555.3±60.0 °C(Predicted)
density 1.512±0.06 g/cm3(Predicted)
storage temp. Keep in dark place,Inert atmosphere,Room temperature
solubility Acetone (Slightly), DMSO (Slightly), Ethyl Acetate (Slightly), Methanol (Slightly)
pka3.91±0.10(Predicted)
color White to Off-White
Stability:Hygroscopic
Major Applicationpharmaceutical
InChIInChI=1S/C13H12N2O5S/c14-10-6-8(13(16)17)7-11(21(15,18)19)12(10)20-9-4-2-1-3-5-9/h1-7H,14H2,(H,16,17)(H2,15,18,19)
InChIKeyGVQZPZSQRCXSJI-UHFFFAOYSA-N
SMILESC(O)(=O)C1=CC(S(N)(=O)=O)=C(OC2=CC=CC=C2)C(N)=C1
Safety Information
WGK Germany WGK 3
Storage Class13 - Non Combustible Solids
MSDS Information
3-amino-5-(aminosulphonyl)-4-phenoxybenzoic acid Usage And Synthesis
UsesA metabolite of Bumetanide (B689550).
3-amino-5-(aminosulphonyl)-4-phenoxybenzoic acid Preparation Products And Raw materials
Tag:3-amino-5-(aminosulphonyl)-4-phenoxybenzoic acid(28328-54-3) Related Product Information
3-Nitro-4-phenoxy-5-sulfaMoylbenzoic Acid Bumetanide-d5 PF 2825 butyl 3-aminosulphonyl-5-butylamino-4-phenoxybenzoate Bumetanide 4-Phenoxybenzoic acid