6-Chloropyridine-3-sulfonamide - CAS 40741-46-6

Catalog:	BB024645
Product Name:	6-Chloropyridine-3-sulfonamide
CAS:	40741-46-6
Synonyms:	6-chloro-3-pyridinesulfonamide; 6-chloropyridine-3-sulfonamide

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	6-chloropyridine-3-sulfonamide
Description:	6-Chloropyridine-3-sulfonamide (CAS# 40741-46-6) is a heterocylic building block used for chemical synthesis. It can also be used for the synthesis of diuretics and carbonic anhydrase inhibitors.
Molecular Weight:	192.62
Molecular Formula:	C5H5ClN2O2S
Canonical SMILES:	C1=CC(=NC=C1S(=O)(=O)N)Cl
InChI:	InChI=1S/C5H5ClN2O2S/c6-5-2-1-4(3-8-5)11(7,9)10/h1-3H,(H2,7,9,10)
InChI Key:	HIBWOQXTHBAGDY-UHFFFAOYSA-N
Boiling Point:	383.2 °C at 760 mmHg
Density:	1.558 g/cm³
LogP:	2.16350

Publication Number	Title	Priority Date
WO-2021188938-A1	Phd inhibitor compounds, compositions, and use	20200320
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Related Functional Groups

Carbonyl Compounds

[5650-34-0]
Oxiran-2-yl(phenyl)methanone
[51493-02-8]
N-Methyl-N-propylcarbamoyl Chloride
[1431966-64-1]
1-{2-[(3-Methoxypropyl)amino]-4-methyl-1,3-thiazol-5-yl}ethanone hydrochloride
[957292-12-5]
2-(3-Cyclopropyl-1H-pyrazol-1-yl)acetic acid
[59855-96-8]
2-(Methoxymethyl)thiazole-5-carboxylic Acid
[1016519-61-1]
2-(Methyl-2-pyridylamino)acetic Acid

GHS Hazard Statement:	H303 (100%): May be harmful if swallowed [Warning Acute toxicity, oral]; H313 (100%): May be harmful in contact with skin [Acute toxicity, dermal]
Precautionary Statement:	P301+P317, and P302+P317
Signal Word:	Warning

Complexity:	223
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	191.9760263
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	191.9760263
Rotatable Bond Count:	1
Topological Polar Surface Area:	81.4
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.4