4-(Methylthio)benzonitrile

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4-(Methylthio)benzonitrile Basic information
Product Name:4-(Methylthio)benzonitrile
Synonyms:P-METHYLTHIO BENZONITRILE;4-Cyanothioanisole~4-(Methylmercapto)benzonitrile;4-METHYLSULFANYL-BENZONITRILE;4-(methylmercapto)benzonitrile;4-cyanothioanisole;4-(METHYLTHIO)BENZONITRILE / 4-CYANOTHIOANISOLE;4-(METHYLTHIO)BENZONITRILE, 98+%;4-Cyanophenyl(methyl) sulfide
CAS:21382-98-9
MF:C8H7NS
MW:149.21
EINECS:628-745-2
Product Categories:Building Blocks;C8 to C9;Chemical Synthesis;Nitrogen Compounds;Organic Building Blocks;C8 to C9;Cyanides/Nitriles;Nitrogen Compounds;Nitriles
Mol File:21382-98-9.mol
4-(Methylthio)benzonitrile Structure
4-(Methylthio)benzonitrile Chemical Properties
Melting point 61-63 °C(lit.)
Boiling point 272 °C(lit.)
density 1.1442 (rough estimate)
refractive index 1.6000 (estimate)
form solid
Water Solubility Insoluble in water.
BRN 2079565
InChI1S/C8H7NS/c1-10-8-4-2-7(6-9)3-5-8/h2-5H,1H3
InChIKeyRPVGEEHGKIFQFO-UHFFFAOYSA-N
SMILESCSc1ccc(cc1)C#N
CAS DataBase Reference21382-98-9(CAS DataBase Reference)
EPA Substance Registry SystemBenzonitrile, 4-(methylthio)- (21382-98-9)
Safety Information
Hazard Codes Xn
Risk Statements 20/21/22-36/37/38
Safety Statements 26-36
RIDADR 3276
WGK Germany 3
HazardClass 6.1
PackingGroup III
HS Code 2930909899
Storage Class11 - Combustible Solids
Hazard ClassificationsAcute Tox. 4 Dermal
Acute Tox. 4 Inhalation
Acute Tox. 4 Oral
Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
MSDS Information
ProviderLanguage
SigmaAldrich English
ALFA English
4-(Methylthio)benzonitrile Usage And Synthesis
Uses4-(Methylthio)benzonitrile was used in the preparation of 4-cyanobenzenethiol.
Synthesis Reference(s)Synthetic Communications, 14, p. 215, 1984 DOI: 10.1080/00397918408060724
General DescriptionSurface-enhanced Raman scattering of 4-(methylthio)benzonitrile adsorbed on silver surface has been investigated.
Tag:4-(Methylthio)benzonitrile(21382-98-9) Related Product Information
4-(Methylthio)benzonitrile 2-(Methylthio)benzonitrile 4-(Methylsulfonyl)benzonitrile PROPERICYAZINE 4-(Trifluoromethylthio)benzonitrile 2-Cyano-phenothiazine N-(5-Cyano-2-[(4-methylphenyl)sulfanyl]phenyl)-3-(trifluoromethyl)benzenecarboxamide 3-Amino-4-[(4-methylphenyl)sulfanyl]benzenecarbonitrile 3-Amino-4-(phenylsulfanyl)benzenecarbonitrile 4-(Phenylthio)phthalonitrile 97 4,4'-Dicyanodiphenylsulphone 2,4-Dichloro-N-(5-cyano-2-[(4-methylphenyl)sulfanyl]phenyl)benzenecarboxamide 4-Chloro-N-(5-cyano-2-[(4-methylphenyl)sulfanyl]phenyl)benzenecarboxamide 4-[(4-Chlorophenyl)sulfanyl]-3-nitrobenzenecarbonitrile N-(5-Cyano-2-[(4-methylphenyl)sulfanyl]phenyl)cyclopropanecarboxamide N-[5-Cyano-2-(phenylsulfanyl)phenyl]-4-methylbenzenecarboxamide N-(5-Cyano-2-[(4-methylphenyl)sulfanyl]phenyl)-3,4,5-trimethoxybenzenecarboxamide N-(5-Cyano-2-[(4-methylphenyl)sulfanyl]phenyl)-2-methylbenzenecarboxamide