3-(trifluoromethyl)benzaldehyde 13C6

Product Name 3-(trifluoromethyl)benzaldehyde 13C6
CAT No. CS-EK-01398
CAS No. 454-89-7 unlabeled
Category Stable Isotopes
Stock Enquire
Mol. Wt. 180.08 g/mol
Mol. For. C213C6H5F3O
Hazardous This is not a Hazardous Compound
COA View Sample COA
MSDS View Sample MSDS
Canonical Smiles C1=CC(=CC(=C1)C(F)(F)F)C=O
InchIKey NMTUHPSKJJYGML-UHFFFAOYSA-N
Inchl InChI=1S/C8H5F3O/c9-8(10,11)7-3-1-2-6(4-7)5-12/h1-5H
IUPAC 3-(trifluoromethyl)benzaldehyde
Controlled No
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[13C6]-3-(trifluoromethyl)benzaldehyde is a compound that is widely used in various research fields, including analytical chemistry, organic synthesis, and pharmacology. This compound is a labeled derivative of 3-(trifluoromethyl)benzaldehyde, with six carbon-13 isotopes incorporated into its molecular structure. This labeling allows for the compound to be used in various applications, including quantitative analysis by mass spectrometry. The chemical formula of [13C6]-3-(trifluoromethyl)benzaldehyde is C9H3F3O, with a molecular weight of 208.11 g/mol. The compound has a melting point of 41-44°C and a boiling point of 141-143°C. It is a white to off-white powder that is soluble in common organic solvents, such as methanol, ethanol, and acetone. In organic synthesis, [13C6]-3-(trifluoromethyl)benzaldehyde is often used as a starting material for the synthesis of other compounds, such as pharmaceutical intermediates and agrochemicals. It is also used as a reagent in various reactions, including aldol condensation and Michael addition. In pharmacology, this compound is used as a reference standard for the identification and quantification of related compounds in drug development. Overall, [13C6]-3-(trifluoromethyl)benzaldehyde is a useful compound in various research fields, providing valuable insights into chemical reactions and molecular structures. Its unique isotopic labeling allows for precise analysis and quantification, making it a valuable tool in many laboratory settings.

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