196894
4-(三氟甲基)苯甲酸
98%
别名:
α,α,α-三氟对甲苯酸, 对三氟甲基苯甲酸
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线性分子式:
CF3C6H4CO2H
化学文摘社编号:
分子量:
190.12
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
EC Number:
207-242-8
Beilstein/REAXYS Number:
2049241
MDL number:
产品名称
4-(三氟甲基)苯甲酸, 98%
InChI key
SWKPKONEIZGROQ-UHFFFAOYSA-N
InChI
1S/C8H5F3O2/c9-8(10,11)6-3-1-5(2-4-6)7(12)13/h1-4H,(H,12,13)
SMILES string
OC(=O)c1ccc(cc1)C(F)(F)F
assay
98%
form
powder
mp
219-220 °C (lit.)
functional group
carboxylic acid
fluoro
Quality Level
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Application
4-（三氟甲基）苯甲酸通过干燥条件下 N,N -二甲基甲酰胺中的 N,N′-二环己基碳二亚胺偶联用于水杨酰苯胺 4-（三氟甲基）苯甲酸酯的合成。它在使用GC/MS 方法的氟化芳香羧酸超痕量分析中作为内标物。
signalword
Warning
hcodes
Hazard Classifications
Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
target_organs
Respiratory system
存储类别
11 - Combustible Solids
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
ppe
dust mask type N95 (US), Eyeshields, Gloves
Fabio Ziarelli et al.
Journal of pharmaceutical and biomedical analysis, 59, 13-17 (2011-11-08)
This work shows that high resolution magic angle spinning (HR-MAS) can be used to elucidate ligand-receptor binding phenomena for mass-limited samples in liquid solution. With respect to conventional 5mm liquid-state NMR probe heads, HR-MAS allows for a considerable reduction (about
Total synthesis of the C-1027 chromophore core: extremely facile enediyne formation through Sml2-mediated 1,2-elimination.
Masayuki Inoue et al.
Angewandte Chemie (International ed. in English), 47(9), 1777-1779 (2008-01-24)
Martin Krátký et al.
Molecules (Basel, Switzerland), 17(8), 9426-9442 (2012-08-09)
Searching for novel antimicrobial agents still represents a current topic in medicinal chemistry. In this study, the synthesis and analytical data of eighteen salicylanilide esters with 4-(trifluoromethyl)benzoic acid are presented. They were assayed in vitro as potential antimycotic agents against
Ultra trace determination of fluorinated aromatic carboxylic acids in aqueous reservoir fluids by solid phase extraction in combination with negative ion chemical ionisation mass spectrometry after derivatisation with pentafluorobenzyl bromide.
Galdiga CU and Greibrokk T.
Fresenius Journal of Analytical Chemistry, 361(8), 797-802 (1998)
K H Engesser et al.
Archives of microbiology, 149(3), 198-206 (1988-01-01)
Enzymes of the p-cymene pathway in Pseudomonas putida strains cometabolized the intermediate analogue 4-trifluoromethyl(TFM)benzoate. Three products, 4-TFM-2,3-dihydro-2,3-dihydroxybenzoate, 4-TFM-2,3-dihydroxybenzoate and 2-hydroxy-6-oxo-7,7,7-trifluorohepta-2,4-dienoate (7-TFHOD) were identified chemically and by spectroscopic properties. Certain TFM-substituted analogue metabolites of the p-cymene pathway were transformed at drastically
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