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Sulfur Compounds
3,5-Bis(methylsulfanyl)-1,2-thiazole-4-carbonyl chloride

3,5-Bis(methylsulfanyl)-1,2-thiazole-4-carbonyl chloride - CAS 4886-16-2

Catalog:	BB045258
Product Name:	3,5-Bis(methylsulfanyl)-1,2-thiazole-4-carbonyl chloride
CAS:	4886-16-2
Synonyms:	4-Isothiazolecarbonyl chloride, 3,5-bis(methylthio)-

Technical Data

Computed Properties

IUPAC Name:	3,5-bis(methylsulfanyl)-1,2-thiazole-4-carbonyl chloride
Description:	3,5-Bis(methylsulfanyl)-1,2-thiazole-4-carbonyl chloride (CAS# 4886-16-2 ) is a useful research chemical.
Molecular Weight:	239.77
Molecular Formula:	C6H6ClNOS3
Canonical SMILES:	CSC1=C(C(=NS1)SC)C(=O)Cl
InChI:	InChI=1S/C6H6ClNOS3/c1-10-5-3(4(7)9)6(11-2)12-8-5/h1-2H3
InChI Key:	RGTALKSXFRVNIG-UHFFFAOYSA-N
Boiling Point:	246.5±40.0 °C
Density:	1.51±0.1 g/cm³

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Related Functional Groups

Halides

[1106917-71-8]
[3-(Difluoromethoxy)phenyl]methanamine hydrochloride
[1448610-48-7]
1-(4-Bromo-3-methylphenyl)cyclobutanol
[932890-93-2]
1-{4-[(2,4-Dichlorobenzyl)oxy]-3-ethoxyphenyl}methanamine
[1431966-58-3]
2,2-Difluoro-N-(2-morpholin-4-ylethyl)ethanamine dihydrochloride
[1431970-24-9]
2,2-Difluoro-N-[1-(1-methylpyrazol-4-yl)ethyl]ethanamine hydrochloride
[73084-03-4]
2,4-di-tert-butyl-6-chloro-1,3,5-triazine

Nitrogen Compounds

[1383427-98-2]
(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
[1170836-25-5]
1-Cyclopentyl-5-nitro-1H-pyrazole
[78056-67-4]
2-(1-Benzyl-4-piperidyl)acetonitrile
[865774-78-3]
2-(6,8-difluoro-1,2,3,4-tetrahydro-naphthalen-2-ylamino)-pentanoic acid methyl ester
[5071-96-5]
3-Methoxybenzylamine
[1328640-88-5]
5-((2,2-Difluoroethoxy)methyl)-1-methyl-3-nitro-1H-pyrazole

Oxazole/Thiazole

[117043-86-4]
4-(Aminomethyl)thiazole Hydrochloride
[1072145-33-5]
ERRα antagonist-1
[56355-79-4]
Ethyl 2-(2-bromothiazol-4-yl)acetate
[6721-80-8]
Ethyl 2-(allylamino)-4-methylthiazole-5-carboxylate
[886497-58-1]
Ethyl 2-(cyclopentylamino)-4-(trifluoromethyl)thiazole-5-carboxylate
[1431962-17-2]
Ethyl 2-(cyclopentylamino)-4-methylthiazole-5-carboxylate hydrochloride

Sulfur Compounds

[85-47-2]
1-Naphthalenesulfonic acid
[71996-48-0]
1-Methyl-2-[(phenylsulfonyl)methyl]benzene
[42729-26-0]
3-(Trifluoromethylthio)phenyl isothiocyanate
[2039-96-5]
3-(Trimethylsilyl)-1-propanesulfonic acid sodium salt
[15863-41-9]
4-(Methylthio)phenyl isothiocyanate
[832739-73-8]
4-(3,5-Dichlorophenyl)pyrimidine-2-thiol

Complexity:	180
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	238.930005
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	5
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	238.930005
Rotatable Bond Count:	3
Topological Polar Surface Area:	109
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3.2