436097
4-Fluoro-2-(trifluoromethyl)benzaldehyde
98%
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About This Item
Linear Formula:
FC6H3(CF3)CHO
CAS Number:
Molecular Weight:
192.11
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
MDL number:
Product Name
4-Fluoro-2-(trifluoromethyl)benzaldehyde, 98%
InChI
1S/C8H4F4O/c9-6-2-1-5(4-13)7(3-6)8(10,11)12/h1-4H
SMILES string
Fc1ccc(C=O)c(c1)C(F)(F)F
InChI key
NONOHEMDNFTKCZ-UHFFFAOYSA-N
assay
98%
form
liquid
refractive index
n20/D 1.452 (lit.)
bp
114 °C (lit.)
density
1.408 g/mL at 25 °C (lit.)
General description
4-Fluoro-2-(trifluoromethyl)benzaldehyde is an organic fluorinated building block. It participates in the synthesis of diphenylthioethers. It also participates in the preparation of 1-cyano derivative of nilutamide.
signalword
Warning
hcodes
Hazard Classifications
Eye Irrit. 2 - Flam. Liq. 3 - Skin Irrit. 2 - STOT SE 3
target_organs
Respiratory system
Storage Class
3 - Flammable liquids
wgk
WGK 3
flash_point_f
134.6 °F - closed cup
flash_point_c
57 °C - closed cup
ppe
Eyeshields, Gloves, type ABEK (EN14387) respirator filter
Regulatory Information
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Peter S Cogan et al.
Journal of medicinal chemistry, 46(24), 5258-5270 (2003-11-14)
The synthesis and preliminary evaluation of a doxorubicin-formaldehyde conjugate tethered to the nonsteroidal antiandrogen, cyanonilutamide (RU 56279), for the treatment of prostate cancer are reported. The relative ability of the targeting group to bind to the human androgen receptor was
Lorna Mitchell et al.
Bioorganic & medicinal chemistry letters, 19(5), 1310-1313 (2009-02-10)
The first examples of thioether-substituted benzonitriles as potential soft-drug androgen receptor antagonists are reported. A number of 4-(alkylthio)- and of 4-(arylthio)-benzonitrile analogs were evaluated in human androgen receptor binding and cellular functional assays. Analogs with potent in vitro binding and
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