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Merck
CN

79178

(Phenylthio)acetonitrile

technical, ≥95% (GC)

Synonym(s):

(Phenylmercapto)acetonitrile

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About This Item

Linear Formula:
C6H5SCH2CN
CAS Number:
Molecular Weight:
149.21
PubChem Substance ID:
UNSPSC Code:
12352100
EC Number:
226-013-3
MDL number:
Beilstein/REAXYS Number:
2042078
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grade

technical

assay

≥95% (GC)

refractive index

n20/D 1.583

bp

146-147 °C/14 mmHg (lit.)

density

1.142 g/mL at 25 °C (lit.)

SMILES string

N#CCSc1ccccc1

Other Notes

Versatile CH-acidic compound; Michael additions; Vicarious substitution of hydrogen in aryls


pictograms

Exclamation mark

signalword

Warning

hcodes

Hazard Classifications

Acute Tox. 4 Oral

Storage Class

10 - Combustible liquids

wgk

WGK 3

flash_point_f

235.4 °F - closed cup

flash_point_c

113 °C - closed cup

ppe

Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter

Regulatory Information

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R.A. Murphy et al.
Tetrahedron Letters, 25, 803-803 (1984)
I. Fleming et al.
Journal of the Chemical Society. Perkin Transactions 1, 256-256 (1981)
N.-Y. Wang et al.
Tetrahedron Letters, 1121-1121 (1979)