542822
4-(Trifluoromethyl)benzamidoxime
97%
Synonym(s):
N-Hydroxy-4-(trifluoromethyl)benzamidine
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About This Item
Linear Formula:
CF3C6H4C(=NOH)NH2
CAS Number:
Molecular Weight:
204.15
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22
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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
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 Code
11 - Combustible Solids
WGK
WGK 3
Flash Point(F)
Not applicable
Flash Point(C)
Not applicable
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves
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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.
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