Tetrahydropyran-4-sulfonyl Chloride - CAS 338453-21-7

Catalog:	BB021860
Product Name:	Tetrahydropyran-4-sulfonyl Chloride
CAS:	338453-21-7
Synonyms:	4-oxanesulfonyl chloride; oxane-4-sulfonyl chloride

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	oxane-4-sulfonyl chloride
Description:	Tetrahydropyran-4-sulfonyl Chloride (CAS# 338453-21-7) is a useful research chemical.
Molecular Weight:	184.64
Molecular Formula:	C5H9ClO3S
Canonical SMILES:	C1COCCC1S(=O)(=O)Cl
InChI:	InChI=1S/C5H9ClO3S/c6-10(7,8)5-1-3-9-4-2-5/h5H,1-4H2
InChI Key:	QQSBPTQNEOJFBO-UHFFFAOYSA-N
Appearance:	White low melting solid
MDL:	MFCD07787616
LogP:	1.81480

Publication Number	Title	Priority Date
WO-2021078022-A1	Small molecule compound	20191024
WO-2021055849-A1	Headgroup lipid compounds and compositions for intracellular delivery of therapeutic agents	20190919
WO-2020210828-A1	(aza)indazolyl-aryl sulfonamide and related compounds and their use in treating medical conditions	20190412
TW-202100520-A	Pyrazolyl pyrimidinylamine compounds as cdk2 inhibitors	20190305
US-2021017156-A1	Pyrazolyl pyrimidinylamine compounds as cdk2 inhibitors	20190305

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Related Functional Groups

Sulfur Compounds

[91125-43-8]
Sulfophenyl nonanoate sodium salt
[518012-62-9]
[2-[2-(2-Methoxyethoxy)ethoxy]ethoxy]p-toluenesulfonate
[6633-90-5]
1,4-Butanedithiol diacetate
[71996-48-0]
1-Methyl-2-[(phenylsulfonyl)methyl]benzene
[1005626-64-1]
3-(1,3-Dimethylpyrazol-4-yl)-5-[(1-methylpyrazol-4-yl)methylidene]-2-sulfanylideneimidazolidin-4-one
[21124-33-4]
Ammonium diethyldithiocarbamate

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:	187
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	183.9960930
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	183.9960930
Rotatable Bond Count:	1
Topological Polar Surface Area:	51.8 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.8