2-Chloroethanesulfonyl chloride - CAS 1622-32-8

Name: 2-Chloroethanesulfonyl chloride
Brand: BOC Sciences
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Catalog:	BB011850
Product Name:	2-Chloroethanesulfonyl chloride
CAS:	1622-32-8
Synonyms:	2-chloroethanesulfonyl chloride

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Computed Properties

IUPAC Name:	2-chloroethanesulfonyl chloride
Description:	2-Chloroethanesulfonyl chloride (CAS# 1622-32-8) is used in the synthesis in irreversible inhibitors of human epidermal growth factor receptor-2 kinase. Also used in the synthesis of potential thrombin inhibitors.
Molecular Weight:	163.02
Molecular Formula:	C2H4Cl2O2S
Canonical SMILES:	C(CCl)S(=O)(=O)Cl
InChI:	InChI=1S/C2H4Cl2O2S/c3-1-2-7(4,5)6/h1-2H2
InChI Key:	VHCSBTPOPKFYIU-UHFFFAOYSA-N
Boiling Point:	202.4 °C at 760 mmHg
Density:	1.547 g/cm³
Appearance:	Colorless liquid
MDL:	MFCD00007461
LogP:	1.87460

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Related Functional Groups

Sulfur Compounds

[91125-43-8]C15H22O5S.Na
Sulfophenyl nonanoate sodium salt
[2006276-82-8]C9H12ClNO4S2
[3-(N,N-Dimethylsulfamoyl)phenyl]methanesulfonyl Chloride
[104496-91-5]C7H9N3OS
2-(Pyridin-2-ylthio)acetohydrazide
[1778-09-2]C9H10OS
4'-(Methylthio)acetophenone
[2096992-18-4]C12H21NO5S
(3-((tert-butoxycarbonyl)amino)bicyclo[1.1.1]pentan-1-yl)methyl methanesulfonate
[52147-97-4]C8H7ClO2S
trans-β-Styrenesulfonyl chloride

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GHS Hazard Statement:	H301 (95.56%): Toxic if swallowed [Danger Acute toxicity, oral]
Precautionary Statement:	P260, P264, P270, P271, P280, P284, P301+P310, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P320, P321, P330, P363, P403+P233, P405, and P501
Signal Word:	Danger

Publication Number	Title	Priority Date
CN-112506005-A	High-adhesion electroplating-resistant photosensitive dry film resist	20201230
CN-112552448-A	Alkali-soluble copolymer and preparation method thereof	20201230
CN-112694499-A	Crosslinking agent, preparation thereof and application thereof in mass spectrum crosslinking technology	20201214
CN-111689882-A	Double-fracture crosslinking agent and preparation method and application thereof	20200624
CN-111689900-A	Aryl pyrazole sulfonyl hydrazide metal complex and ultrasonic radiation synthesis method and application thereof	20200616

PMID	Publication Date	Title	Journal
21268583	20110223	A domino approach (hydrolysis/dehydrohalogenation/Heck coupling) for the synthesis of styrene sulfonate salts	Journal of the American Chemical Society
17164917	20070107	A new strategy for the synthesis of taurine derivatives using the 'safety-catch' principle for the protection of sulfonic acids	Organic & biomolecular chemistry
17406571	20060101	Thermal and high pressure intramolecular Diels-Alder reaction of vinylsulfonamides	Nature protocols
11462982	20010201	Tyrosine kinase inhibitors. 18. 6-Substituted 4-anilinoquinazolines and 4-anilinopyrido[3,4-d]pyrimidines as soluble, irreversible inhibitors of the epidermal growth factor receptor	Journal of medicinal chemistry

Complexity:	121
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	161.9309059
Formal Charge:	0
Heavy Atom Count:	7
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	161.9309059
Rotatable Bond Count:	2
Topological Polar Surface Area:	42.5 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1