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Key Documents

184365

Sigma-Aldrich

(Methylsulfonyl)acetonitrile

97%

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About This Item

Linear Formula:
CH3SO2CH2CN
CAS Number:
Molecular Weight:
119.14
EC Number:
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22

assay

97%

mp

81-84 °C (lit.)

functional group

nitrile

SMILES string

CS(=O)(=O)CC#N

InChI

1S/C3H5NO2S/c1-7(5,6)3-2-4/h3H2,1H3

InChI key

FOTRKCAZUSJCQD-UHFFFAOYSA-N

Application

(Methylsulfonyl)acetonitrile was used in the synthesis of:
  • substituted δ-pyrone ring analogues
  • 4,9-dihydropyrrolo[2,1-b]quinazolines containing electron withdrawing groups at the 3-position

pictograms

Exclamation mark

signalword

Warning

Hazard Classifications

Acute Tox. 4 Dermal - Acute Tox. 4 Inhalation - Acute Tox. 4 Oral

Storage Class

6.1C - Combustible acute toxic Cat.3 / toxic compounds or compounds which causing chronic effects

wgk_germany

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

dust mask type N95 (US), Eyeshields, Gloves


Certificates of Analysis (COA)

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A novel entry to substituted chromones and furochromones through cyclopropane intermediates.
Gammill RB, et al.
Tetrahedron Letters, 33(8), 997-1000 (1992)
An Intramolecular N-Arylation Approach to 3-Functionalized 4, 9-Dihydropyrrolo [2, 1-b] quinazolines.
Suthiwangcharoen N, et al.
Journal of Heterocyclic Chemistry, 48(3), 706-709 (2011)

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