2-chloro-pyrimidine-5-sulfonyl chloride - CAS 98026-88-1

Catalog:	BB042096
Product Name:	2-chloro-pyrimidine-5-sulfonyl chloride
CAS:	98026-88-1
Synonyms:	2-chloro-5-pyrimidinesulfonyl chloride; 2-chloropyrimidine-5-sulfonyl chloride

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	2-chloropyrimidine-5-sulfonyl chloride
Description:	2-chloro-pyrimidine-5-sulfonyl chloride (CAS# 98026-88-1) is a useful research chemical.
Molecular Weight:	213.04
Molecular Formula:	C4H2Cl2N2O2S
Canonical SMILES:	C1=C(C=NC(=N1)Cl)S(=O)(=O)Cl
InChI:	InChI=1S/C4H2Cl2N2O2S/c5-4-7-1-3(2-8-4)11(6,9)10/h1-2H
InChI Key:	DMAOAJYJIATWJS-UHFFFAOYSA-N
Purity:	95 %
Storage:	Inert atmosphere, Room Temperature
MDL:	MFCD06657208
LogP:	2.13830

Publication Number	Title	Priority Date
WO-2020178316-A1	5- or 7-azaindazoles as beta-lactamase inhibitors	20190305
WO-2020164971-A1	Pre-harvest desiccation method	20190211
TW-202045002-A	Pre-harvest desiccation method	20190211
CN-113423271-A	Pre-harvest drying method	20190211
AU-2018316526-A1	Herbicidal compounds	20170817

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Related Functional Groups

Sulfur Compounds

[123-43-3]
Sulfoacetic acid
[518012-62-9]
[2-[2-(2-Methoxyethoxy)ethoxy]ethoxy]p-toluenesulfonate
[2006276-82-8]
[3-(N,N-Dimethylsulfamoyl)phenyl]methanesulfonyl Chloride
[6633-90-5]
1,4-Butanedithiol diacetate
[71996-48-0]
1-Methyl-2-[(phenylsulfonyl)methyl]benzene
[104496-91-5]
2-(Pyridin-2-ylthio)acetohydrazide

GHS Hazard Statement:	H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
Precautionary Statement:	P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P405, and P501
Signal Word:	Danger

Complexity:	217
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	211.9214039
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	211.9214039
Rotatable Bond Count:	1
Topological Polar Surface Area:	68.3 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.2