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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.)

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

Signal Word

Warning

Hazard Statements

Hazard Classifications

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

Storage Class Code

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

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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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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