472190
2-Fluoro-5-(trifluoromethyl)phenyl isocyanate
97%
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About This Item
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Quality Level
Assay
97%
refractive index
n20/D 1.455 (lit.)
bp
53 °C/2.5 mmHg (lit.)
density
1.418 g/mL at 25 °C (lit.)
SMILES string
Fc1ccc(cc1N=C=O)C(F)(F)F
InChI
1S/C8H3F4NO/c9-6-2-1-5(8(10,11)12)3-7(6)13-4-14/h1-3H
InChI key
NAIKHCBDZGSGHH-UHFFFAOYSA-N
General description
2-Fluoro-5-(trifluoromethyl)phenyl isocyanate is a fluorinated building block.
Application
Useful pharmaceutical building block for the preparation of ureas from amines.
Signal Word
Danger
Hazard Statements
Precautionary Statements
Hazard Classifications
Acute Tox. 4 Dermal - Acute Tox. 4 Inhalation - Acute Tox. 4 Oral - Eye Irrit. 2 - Resp. Sens. 1 - Skin Irrit. 2 - Skin Sens. 1 - STOT SE 3
Target Organs
Respiratory system
Storage Class Code
10 - Combustible liquids
WGK
WGK 3
Flash Point(F)
159.8 °F - closed cup
Flash Point(C)
71 °C - closed cup
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves
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Bioorganic & medicinal chemistry letters, 16(16), 4326-4330 (2006-06-01)
A series of isothiazolopyrimidines and isoxazolopyrimidines were synthesized and identified as potent KDR inhibitors. SAR studies led to isothiazolopyrimidine urea analogs that potently inhibit VEGFR tyrosine kinases (KDR enzymatic and cellular IC(50) values below 10 nM) as well as cKIT
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