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2-Bromoethyl Methyl Sulfone

2-Bromoethyl Methyl Sulfone - CAS 16523-02-7

Catalog:	BB012175
Product Name:	2-Bromoethyl Methyl Sulfone
CAS:	16523-02-7
Synonyms:	1-bromo-2-methylsulfonylethane; 1-bromo-2-methylsulfonylethane

Technical Data

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Computed Properties

IUPAC Name:	1-bromo-2-methylsulfonylethane
Description:	2-Bromoethyl Methyl Sulfone (CAS# 16523-02-7) is a reagent used in the preparation of sulfone-functionalized imidazolium ionic liquid electrolytes, which has electrochemical properties.
Molecular Weight:	187.06
Molecular Formula:	C3H7BrO2S
Canonical SMILES:	CS(=O)(=O)CCBr
InChI:	InChI=1S/C3H7BrO2S/c1-7(5,6)3-2-4/h2-3H2,1H3
InChI Key:	NIEGKADUBXVLHF-UHFFFAOYSA-N
LogP:	1.50670

Publication Number	Title	Priority Date
CN-113372335-A	Phenylalanine derivative containing 1,2, 4-triazole thioether and preparation method and application thereof	20210705
CN-113121393-A	Aromatic amide compound and application thereof in medicines	20191231
WO-2021136326-A1	Aryl amide compound and application thereof in medicine	20191231
CN-112876419-A	Allylamine derivatives, process for producing the same and use thereof	20191129
WO-2021047406-A1	Tricyclic compound, pharmaceutical composition containing same, preparation method therefor and use thereof	20190910

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GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P332+P313, P362, P403+P233, P405, and P501
Signal Word:	Danger

Complexity:	120
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	185.93501
Formal Charge:	0
Heavy Atom Count:	7
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	185.93501
Rotatable Bond Count:	2
Topological Polar Surface Area:	42.5 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.4