3,5-Dimethoxybenzenesulfonyl Chloride - CAS 80563-82-2

Catalog:	BB036522
Product Name:	3,5-Dimethoxybenzenesulfonyl Chloride
CAS:	80563-82-2
Synonyms:	3,5-dimethoxybenzenesulfonyl chloride; 3,5-dimethoxybenzenesulfonyl chloride

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	3,5-dimethoxybenzenesulfonyl chloride
Description:	3,5-Dimethoxybenzenesulfonyl Chloride (CAS# 80563-82-2) is a useful research chemical.
Molecular Weight:	236.67
Molecular Formula:	C8H9ClO4S
Canonical SMILES:	COC1=CC(=CC(=C1)S(=O)(=O)Cl)OC
InChI:	InChI=1S/C8H9ClO4S/c1-12-6-3-7(13-2)5-8(4-6)14(9,10)11/h3-5H,1-2H3
InChI Key:	YJDHWSWHDQCMRG-UHFFFAOYSA-N
LogP:	2.71210

Publication Number	Title	Priority Date
WO-2014207508-A1	Pyridyl compound suitable for the treatment of metabolic disorders	20130627
AU-2006286348-A1	Pyrrolopyridine derivatives and use of same as PPAR receptor modulators	20050901
AU-2006286348-B2	Pyrrolopyridine derivatives and use of same as PPAR receptor modulators	20050901
BR-PI0615335-A2	new pyrrolopyridine compounds	20050901
CN-101242833-A	Pyrrolopyridine derivatives and use of same as PPAR receptor modulators	20050901

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Related Functional Groups

Sulfur Compounds

[91125-43-8]
Sulfophenyl nonanoate sodium salt
[1866059-82-6]
1,1,2,2-Tetrafluoro-3-methylsulfonylpropane
[104496-91-5]
2-(Pyridin-2-ylthio)acetohydrazide
[1005626-64-1]
3-(1,3-Dimethylpyrazol-4-yl)-5-[(1-methylpyrazol-4-yl)methylidene]-2-sulfanylideneimidazolidin-4-one
[1778-09-2]
4'-(Methylthio)acetophenone
[2170450-99-2]
4-Methyl-1-(phenylsulfonyl)-1H-indole-2-carbonitrile

GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]; H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
Precautionary Statement:	P260, P264, P270, P280, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P330, P363, P405, and P501
Signal Word:	Danger

Complexity:	260
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	235.9910076
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	235.9910076
Rotatable Bond Count:	3
Topological Polar Surface Area:	61
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.9