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Sigma-Aldrich

4-(Methylthio)benzonitrile

98%

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About This Item

Linear Formula:
CH3SC6H4CN
CAS Number:
Molecular Weight:
149.21
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22

Assay

98%

form

solid

bp

272 °C (lit.)

mp

61-63 °C (lit.)

functional group

nitrile

SMILES string

CSc1ccc(cc1)C#N

InChI

1S/C8H7NS/c1-10-8-4-2-7(6-9)3-5-8/h2-5H,1H3

InChI key

RPVGEEHGKIFQFO-UHFFFAOYSA-N

General description

Surface-enhanced Raman scattering of 4-(methylthio)benzonitrile adsorbed on silver surface has been investigated.

Application

4-(Methylthio)benzonitrile was used in the preparation of 4-cyanobenzenethiol.

Pictograms

Exclamation mark

Signal Word

Warning

Hazard Classifications

Acute Tox. 4 Dermal - Acute Tox. 4 Inhalation - Acute Tox. 4 Oral - Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

Target Organs

Respiratory system

Storage Class Code

11 - Combustible Solids

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Certificates of Analysis (COA)

Search for Certificates of Analysis (COA) by entering the products Lot/Batch Number. Lot and Batch Numbers can be found on a product’s label following the words ‘Lot’ or ‘Batch’.

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Investigation of adsorption and decomposition of 4-(methylthio) benzonitrile on a silver surface by Raman spectroscopy.
Yi SS, et al.
Journal of Raman Spectroscopy, 24(4), 213-219 (1993)
Unsymmetrical aryl disulfides with excellent transparency in the visible region for second order nonlinear optics.
Sudharsanam R, et al.
Journal of Materials Chemistry, 12(10), 2904-2908 (2002)

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