4-(Trifluoroacetylamino)benzoic Acid-d4

Product Name 4-(Trifluoroacetylamino)benzoic Acid-d4
CAT No. CS-T-87641
CAS No. 461426-32-4
Category Stable Isotopes
Stock IN-Stock
Mol. Wt. 237.17 g/mol
Mol. For. C9H2D4F3NO3
Hazardous This is not a Hazardous Compound
COA View Sample COA
MSDS View Sample MSDS
Smileys O=C(O)C1=C([2H])C([2H])=C(NC(C(F)(F)F)=O)C([2H])=C1[2H]
Canonical Smiles C1=CC(=CC=C1C(=O)O)NC(=O)C(F)(F)F
InchIKey TZDURDLECJWHJD-RHQRLBAQSA-N
Inchl InChI=1S/C9H6F3NO3/c10-9(11,12)8(16)13-6-3-1-5(2-4-6)7(14)15/h1-4H,(H,13,16)(H,14,15)/i1D,2D,3D,4D
IUPAC 2,3,5,6-tetradeuterio-4-[(2,2,2-trifluoroacetyl)amino]benzoic acid
Controlled No
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4-(Trifluoroacetylamino)benzoic Acid-d4 is a deuterated form of 4-(Trifluoroacetylamino)benzoic Acid, which is a derivative of benzoic acid. It is widely used in various research fields, including medicinal chemistry, drug discovery, and analytical chemistry. This compound is a stable isotope-labeled compound that is used as a reference standard in mass spectrometry (MS) and nuclear magnetic resonance (NMR) spectroscopy analysis. 4-(Trifluoroacetylamino)benzoic Acid-d4 is a white crystalline powder with a molecular formula of C9H4D4F3NO3. It has a molecular weight of 250.2 g/mol. This compound has a melting point of 218-220°C and is soluble in organic solvents such as methanol, ethanol, and acetonitrile. In the field of medicinal chemistry, 4-(Trifluoroacetylamino)benzoic Acid-d4 is used as a reference standard in the development of drugs. It is also used in drug metabolism and pharmacokinetic studies. In analytical chemistry, this compound is used as a reference standard in the characterization and quantitation of pharmaceutical compounds in complex matrices. In conclusion, 4-(Trifluoroacetylamino)benzoic Acid-d4 is a useful compound in various research fields. Its stable isotope-labeled nature makes it a valuable reference standard in mass spectrometry and nuclear magnetic resonance spectroscopy analysis, while its applications in medicinal and analytical chemistry make it a versatile compound in drug discovery and drug characterization.

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