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542822

4-(Trifluoromethyl)benzamidoxime

Name: 4-(Trifluoromethyl)benzamidoxime
Brand: ALDRICH

97%

Synonym(s):

N-Hydroxy-4-(trifluoromethyl)benzamidine

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About This Item

Linear Formula:

CF₃C₆H₄C(=NOH)NH₂

CAS Number:

22179-86-8

Molecular Weight:

204.15

NACRES:

NA.22

PubChem Substance ID:

24878638

UNSPSC Code:

12352100

MDL number:

MFCD00053042

Assay:

97%

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Properties

Quality Level

100

assay

97%

mp

125-130 °C (lit.)

functional group

amine, fluoro, oxime

SMILES string

N\C(=N/O)c1ccc(cc1)C(F)(F)F

InChI

1S/C8H7F3N2O/c9-8(10,11)6-3-1-5(2-4-6)7(12)13-14/h1-4,14H,(H2,12,13)

InChI key

QCVFLUSIBKAKPC-UHFFFAOYSA-N

Description

Application

4-(Trifluoromethyl)benzamidoxime (N-Hydroxy-4-(trifluoromethyl)benzamidine) may be used to synthesize 5-(3-chlorothiophen-2-yl)-3-(4-trifluoromethylphenyl)-1,2,4-oxadiazole, a potential anticancer agent.

Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

Eyeshields, Gloves, type N95 (US)

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Certificates of Analysis (COA)

Lot/Batch Number

05616JH

06420PI

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Discovery and structure-activity relationship of 3-aryl-5-aryl-1,2,4-oxadiazoles as a new series of apoptosis inducers and potential anticancer agents.

Han-Zhong Zhang et al.

Journal of medicinal chemistry, 48(16), 5215-5223 (2005-08-05)

We have identified 5-(3-chlorothiophen-2-yl)-3-(4-trifluoromethylphenyl)-1,2,4-oxadiazole (1d) as a novel apoptosis inducer through our caspase- and cell-based high-throughput screening assay. Compound 1d has good activity against several breast and colorectal cancer cell lines but is inactive against several other cancer cell lines.

Global Trade Item Number

SKU	GTIN
542822-1G	04061825771205