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Key Documents

196932

Sigma-Aldrich

3-Methoxy-5-(trifluoromethyl)aniline

99%

Synonym(s):

5-Methoxy-α,α,α-trifluoro-m-toluidine

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About This Item

Linear Formula:
CH3OC6H3(CF3)NH2
CAS Number:
Molecular Weight:
191.15
EC Number:
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
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Assay

99%

form

solid

mp

50-52 °C (lit.)

functional group

fluoro

SMILES string

COc1cc(N)cc(c1)C(F)(F)F

InChI

1S/C8H8F3NO/c1-13-7-3-5(8(9,10)11)2-6(12)4-7/h2-4H,12H2,1H3

InChI key

VTFGJEYZCUWSAM-UHFFFAOYSA-N

Application

3-Methoxy-5-(trifluoromethyl)aniline was used in the synthesis of spleen tyrosine kinase inhibitors based on the phenylamino pyrimidine thiazole[1].

Pictograms

Exclamation mark

Signal Word

Warning

Hazard Classifications

Acute Tox. 4 Dermal - Acute Tox. 4 Inhalation - Acute Tox. 4 Oral - Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

Target Organs

Respiratory system

Storage Class Code

11 - Combustible Solids

WGK

WGK 3

Flash Point(F)

235.4 °F - closed cup

Flash Point(C)

113 °C - closed cup

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

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Luc J Farmer et al.
Bioorganic & medicinal chemistry letters, 18(23), 6231-6235 (2008-10-22)
A series of SYK inhibitors based on the phenylamino pyrimidine thiazole lead 4 were prepared and evaluated for biological activity. Lead optimization provided compounds with nanomolar K(i)'s against SYK and potent inhibition in mast cell degranulation assays.

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