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4-chloro-3-nitro-5-sulphamoylbenzoic acid

4-chloro-3-nitro-5-sulphamoylbenzoic acid - CAS 22892-96-2

Catalog:	BB053852
Product Name:	4-chloro-3-nitro-5-sulphamoylbenzoic acid
CAS:	22892-96-2
Synonyms:	Benzoic acid, 3-(aminosulfonyl)-4-chloro-5-nitro-; 2-chloro-3-nitro-5-carboxy-benzenesulphonamide
Application:	Intermediate in the production of Bumetanide

4-chloro-3-nitro-5-sulphamoylbenzoic acid

Technical Data

Safety and Hazards

Computed Properties

IUPAC Name:	4-chloro-3-nitro-5-sulfamoylbenzoic acid
Molecular Weight:	280.64
Molecular Formula:	C7H5ClN2O6S
Canonical SMILES:	C1=C(C=C(C(=C1[N+](=O)[O-])Cl)S(=O)(=O)N)C(=O)O
InChI:	InChI=1S/C7H5ClN2O6S/c8-6-4(10(13)14)1-3(7(11)12)2-5(6)17(9,15)16/h1-2H,(H,11,12)(H2,9,15,16)
InChI Key:	ACYLUAGCBGTEJF-UHFFFAOYSA-N
Boiling Point:	563.5±60.0 °C at 760 mmHg
Melting Point:	227-231 °C
Purity:	95%
Density:	1.8±0.1 g/cm3
Solubility:	Soluble in DMSO (Slightly), Methanol (Slightly)
Appearance:	Off-White to Light Beige Solid
Storage:	Store at -20 °C

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