Sodium methanesulfinate - CAS 20277-69-4

Catalog:	BB015757
Product Name:	Sodium methanesulfinate
CAS:	20277-69-4
Synonyms:	sodium;methanesulfinate

Technical Data

Safety and Hazards

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Computed Properties

IUPAC Name:	sodium;methanesulfinate
Description:	Sodium methylsulfinate can be used to synthesize cyclooxygenase-2 inhibitors.
Molecular Weight:	102.09
Molecular Formula:	CH3NaO2S
Canonical SMILES:	CS(=O)[O-].[Na+]
InChI:	InChI=1S/CH4O2S.Na/c1-4(2)3;/h1H3,(H,2,3);/q;+1/p-1
InChI Key:	LYPGDCWPTHTUDO-UHFFFAOYSA-M
Boiling Point:	256.4 °C at 760 mmHg
Melting Point:	222-226 °C
Purity:	95 %
Appearance:	White to light beige powder
MDL:	MFCD00040392
LogP:	0.36100

Publication Number	Title	Priority Date
CN-113307749-A	Method for synthesizing beta-ketosulfone derivative under mild condition and obtained beta-ketosulfone derivative	20210526
CN-113121499-A	Synthetic method and application of omeprazole	20210413
CN-113005473-A	Method for preparing spiro [5.5] molecular skeleton compound through electrooxidation amination	20210323
CN-112624943-A	Synthesis method of feloxicib intermediate	20201228
CN-112574077-A	Method for synthesizing sulfone compound under photocatalysis condition	20201212

PMID	Publication Date	Title	Journal
22967540	20120915	Synthesis and application of a Sec2-containing oligopeptide for method evaluation purposes in selenium speciation	Talanta
17467897	20071001	Degradation of DMSO by ozone-based advanced oxidation processes	Journal of hazardous materials
16122156	20050801	Ratiometric fluorescence response of N-methylacridone for methanesulfonic acid	Analytical sciences : the international journal of the Japan Society for Analytical Chemistry
15535966	20041118	Reevaluating the role of 1,10-phenanthroline in oxidative reactions involving ferrous ions and DNA damage	Biochimica et biophysica acta
12913269	20030801	HPLC analysis of fatty acyl-glycine in the aqueous methanesulfonic acid hydrolysates of N-terminally fatty acylated peptides	Biological & pharmaceutical bulletin

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Related Functional Groups

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[874-87-3]
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[2170450-99-2]
4-Methyl-1-(phenylsulfonyl)-1H-indole-2-carbonitrile

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GHS Hazard Statement:	H302 (97.96%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P264, P270, P301+P312, P330, and P501
Signal Word:	Warning

Complexity:	36.6
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	2
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	101.97514479
Formal Charge:	0
Heavy Atom Count:	5
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	101.97514479
Rotatable Bond Count:	0
Topological Polar Surface Area:	59.3 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0