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Assay
98%
refractive index
n20/D 1.45 (lit.)
bp
118-119 °C (lit.)
density
1.41 g/mL at 25 °C (lit.)
SMILES string
Fc1cc(ccc1C=O)C(F)(F)F
InChI
1S/C8H4F4O/c9-7-3-6(8(10,11)12)2-1-5(7)4-13/h1-4H
InChI key
KFEHNXLFIGPWNB-UHFFFAOYSA-N
Application
2-Fluoro-4-(trifluoromethyl)benzaldehyde may be used in the synthesis of methyl 3-amino-6-(trifluoromethyl)benzo[b]thiophene-2-carboxylate.
Signal Word
Warning
Hazard Statements
Precautionary Statements
Hazard Classifications
Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
Target Organs
Respiratory system
Storage Class Code
10 - Combustible liquids
WGK
WGK 3
Flash Point(F)
230.0 °F - closed cup
Flash Point(C)
110 °C - closed cup
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves
Certificates of Analysis (COA)
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Thermophysical Properties of Chemicals and Hydrocarbons, 548-548 (2014)
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Microwave irradiation of 2-halobenzonitriles and methyl thioglycolate in the presence of triethylamine in DMSO at 130 °C provides rapid access to 3-aminobenzo[b]thiophenes in 58-96% yield. This transformation has been applied in the synthesis of the thieno[2,3-b]pyridine core motif of LIMK1
Journal of fluorine chemistry, 203, 193-199 (2018-01-10)
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