CAS 206986-86-9

Chloro[2-(trifluoromethyl)phenyl]methyl carbonochloridate

Description:

Chloro[2-(trifluoromethyl)phenyl]methyl carbonochloridate, with the CAS number 206986-86-9, is a chemical compound characterized by its unique structure that includes a chloro group, a trifluoromethyl-substituted phenyl ring, and a carbonochloridate functional group. This compound is typically used in organic synthesis, particularly in the development of pharmaceuticals and agrochemicals, due to its reactivity and ability to introduce functional groups into various substrates. It is a colorless to pale yellow liquid, exhibiting moderate volatility and solubility in organic solvents. The presence of the trifluoromethyl group enhances its lipophilicity and biological activity, making it an interesting candidate for further research. Safety precautions should be taken when handling this compound, as it may be toxic and irritant, necessitating the use of appropriate personal protective equipment. Overall, its distinctive chemical properties and potential applications make it a compound of interest in the field of synthetic organic chemistry.

Formula: C₉H₅Cl₂F₃O₂

InChI: InChI=1S/C9H5Cl2F3O2/c10-7(16-8(11)15)5-3-1-2-4-6(5)9(12,13)14/h1-4,7H

InChI key: InChIKey=KQELEQGMABOYIM-UHFFFAOYSA-N

SMILES: C(OC(Cl)=O)(Cl)C1=C(C(F)(F)F)C=CC=C1

Synonyms:

• Carbonochloridic acid, chloro[2-(trifluoromethyl)phenyl]methyl ester
• Chloro[2-(trifluoromethyl)phenyl]methyl carbonochloridate
• alpha-Chloro-2-(trifluoromethyl)benzyl chloroformate

Carbonochloridic acid, chloro[2-(trifluoromethyl)phenyl]methyl ester

CAS: 206986-86-9

Formula: C₉H₅Cl₂F₃O₂

Molecular weight: 273.036

Ref: IN-DA002ISF