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17733-22-1

17733-22-1 Structure

17733-22-1 Structure
IdentificationMore
[Name]

2-CHLOROTHIOANISOLE
[CAS]

17733-22-1
[Synonyms]

1-CHLORO-2-(METHYLTHIO)BENZENE
2-CHLOROPHENYL METHYL SULFIDE
2-CHLOROTHIOANISOLE
2-Chloro-alpha-toluenethiol
1-Chloro-2-(methylthio)benzene, 2-Chlorophenyl methyl sulphide
2-Chloro-1-(methylthio)benzene
2-CHLOROTHIOSANISOLE
2-Chlorobenzyl mercaptan, 97+%
Benzene, 1-chloro-2-(methylthio)-
2-CHLORO THIOANISOLE 99%
(2-chlorophenyl)(methyl)sulfane
1-(Methylthio)-2-chlorobenzene
1-Methylthio-2-chlorobenzene
Methyl (2-chlorophenyl) sulfide
Methyl [2-chlorophenyl] sulfide
Methyl 2-chlorophenyl sulfide
2-Chlorobenzyl thioalcohol
[Molecular Formula]

C7H7ClS
[MDL Number]

MFCD00040124
[Molecular Weight]

158.65
[MOL File]

17733-22-1.mol
Chemical PropertiesBack Directory
[Boiling point ]

239-240 °C (lit.)
[density ]

1,22 g/cm3
[refractive index ]

n20/D 1.608(lit.)
[Fp ]

>230 °F
[storage temp. ]

Sealed in dry,Room Temperature
[Appearance]

Colorless to light yellow Liquid
[Sensitive ]

Stench
[InChI]

1S/C7H7ClS/c1-9-7-5-3-2-4-6(7)8/h2-5H,1H3
[InChIKey]

IHLDFHCSSCVPQW-UHFFFAOYSA-N
[SMILES]

CSc1ccccc1Cl
[CAS DataBase Reference]

17733-22-1(CAS DataBase Reference)
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
[RIDADR ]

UN 3334
[WGK Germany ]

3
[Hazard Note ]

Irritant/Stench
[HazardClass ]

STENCH
[HS Code ]

2909309090
[Storage Class]

10 - Combustible liquids
[Hazard Classifications]

Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Hazard InformationBack Directory
[Uses]

2-Chlorothioanisole may be used to synthesize 2-chlorophenyl methyl sulfone.
[Synthesis Reference(s)]

The Journal of Organic Chemistry, 48, p. 3114, 1983 DOI: 10.1021/jo00166a040
[General Description]

2-Chlorothioanisole can be prepared from the reaction between N,N-dimethylformamide, 1,2-dichlorobenzene, finely ground KOH and methyl mercaptan. Benzene dipole moment value analysis of 2-chlorothioanisole indicates that it exists predominantly in trans- form. 1H NMR spectrum of 2-chlorothioanisole has been studied in acetone-d6 solution.
Spectrum DetailBack Directory
[Spectrum Detail]

2-CHLOROTHIOANISOLE(17733-22-1)MS
2-CHLOROTHIOANISOLE(17733-22-1)1HNMR
2-CHLOROTHIOANISOLE(17733-22-1)IR1
Well-known Reagent Company Product InformationBack Directory
[Sigma Aldrich]

17733-22-1(sigmaaldrich)
[TCI AMERICA]

2-Chlorothioanisole,>98.0%(GC)(17733-22-1)
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