771333

Diethyl 4-(trifluoromethyl)benzylphosphonate

97%

• Empirical Formula (Hill Notation): C₁₂H₁₆F₃O₃P
• CAS Number: 99578-68-4
• Molecular Weight: 296.22
• MDL number: MFCD09836731
• UNSPSC Code: 12352100
• PubChem Substance ID: 329767489
• NACRES: NA.22

Properties

• Assay: 97%
• form: liquid
• reaction suitability: reaction type: Buchwald-Hartwig Cross Coupling Reaction; reaction type: Heck Reaction; reaction type: Hiyama Coupling; reaction type: Negishi Coupling; reaction type: Sonogashira Coupling; reaction type: Stille Coupling; reaction type: Suzuki-Miyaura Coupling
• refractive index: n20/D 1.456
• density: 1.227 g/mL at 25 °C
• SMILES string: O=P(OCC)(OCC)CC1=CC=C(C(F)(F)F)C=C1
• InChI: 1S/C12H16F3O3P/c1-3-17-19(16,18-4-2)9-10-5-7-11(8-6-10)12(13,14)15/h5-8H,3-4,9H2,1-2H3
• InChI key: NTQKMIQYHZLRSW-UHFFFAOYSA-N

Safety Information

• Storage Class Code: 10 - Combustible liquids
• WGK: WGK 3
• Flash Point(F): Not applicable
• Flash Point(C): Not applicable