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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%
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.
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.
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Galvez-Llompart M, et al.
Letters in Drug Design & Discovery, 7(6), 438-445 (2010)
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