140333

Benzyl 2,2,2-trichloroacetimidate

≥96%

• Synonym(s): 2,2,2-Trichloroacetimidic acid benzyl ester
• Linear Formula: CCl₃C(=NH)OCH₂C₆H₅
• CAS Number: 81927-55-1
• Molecular Weight: 252.52
• Beilstein: 2525375
• MDL number: MFCD00000805
• UNSPSC Code: 12352100
• PubChem Substance ID: 24848466
• NACRES: NA.22

Properties

• Assay: ≥96%
• form: liquid
• impurities: <1% benzyl alcohol
• refractive index: n20/D 1.545 (lit.)
• bp: 106-114 °C/0.5 mmHg (lit.)
• transition temp: solidification point 3-4 °C
• density: 1.359 g/mL at 25 °C (lit.)
• functional group: chloro; ether; phenyl
• storage temp.: 2-8°C
• SMILES string: ClC(Cl)(Cl)C(=N)OCc1ccccc1
• InChI: 1S/C9H8Cl3NO/c10-9(11,12)8(13)14-6-7-4-2-1-3-5-7/h1-5,13H,6H2
• InChI key: HUZCTWYDQIQZPM-UHFFFAOYSA-N

Description

Application

Benzyl 2,2,2-trichloroacetimidate was used as reagent during the synthesis of funiculosin dimethyl ether and (S)-3-(benzyloxy)-2-methylpropanal. It was used in the acid-catalyzed benzylation of hydroxy groups.

Safety Information

• Pictograms: GHS07
• Signal Word: Warning
• Hazard Statements: H302,H315,H319,H335
• Precautionary Statements: P301 + P312 + P330 - P302 + P352 - P305 + P351 + P338
• Hazard Classifications: Acute Tox. 4 Oral - Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
• Target Organs: Respiratory system
• Storage Class Code: 10 - Combustible liquids
• WGK: WGK 3
• Flash Point(F): 235.4 °F - closed cup
• Flash Point(C): 113 °C - closed cup
• Personal Protective Equipment: dust mask type N95 (US), Eyeshields, Gloves