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Merck
CN

144193

4,6-Dichloro-2-methylthio-5-phenylpyrimidine

95%

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About This Item

Empirical Formula (Hill Notation):
C11H8Cl2N2S
CAS Number:
Molecular Weight:
271.17
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
EC Number:
264-877-3
MDL number:
Assay:
95%
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InChI key

LMTMZMBTPXASSW-UHFFFAOYSA-N

InChI

1S/C11H8Cl2N2S/c1-16-11-14-9(12)8(10(13)15-11)7-5-3-2-4-6-7/h2-6H,1H3

SMILES string

CSc1nc(Cl)c(c(Cl)n1)-c2ccccc2

assay

95%

mp

107-111 °C (lit.)

functional group

chloro, phenyl, thioether

Application

4,6-Dichloro-2-methylthio-5-phenylpyrimidine was used in the synthesis of cinchona alkaloid-derived catalysts.

Biochem/physiol Actions

4,6-Dichloro-2-methylthio-5-phenylpyrimidine has significant in vivo antinflammatory activity.

pictograms

CorrosionExclamation mark

signalword

Danger

hcodes

Hazard Classifications

Eye Dam. 1 - Skin Corr. 1B - STOT SE 3

target_organs

Respiratory system

Storage Class

8A - Combustible corrosive hazardous materials

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

Eyeshields, Faceshields, Gloves, type P3 (EN 143) respirator cartridges

Regulatory Information

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Michael A Calter et al.
Organic letters, 13(23), 6328-6330 (2011-11-08)
A new variant of the Interrupted Feist-Bénary (IFB) reaction uses α-tosyloxyacetophenones as electrophiles and proceeds in good yields and excellent enantioselectivities.
Application of molecular topology to the search of novel NSAIDs: experimental validation of activity.
Galvez-Llompart M, et al.
Letters in Drug Design & Discovery, 7(6), 438-445 (2010)

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