4-(3,5-Difluorophenyl)-2,2-dimethyl-4-oxobutanoic acid
[CAS# 898766-68-2]

Identification

• Name: 4-(3,5-Difluorophenyl)-2,2-dimethyl-4-oxobutanoic acid
• Synonyms: 4-(3,5-Difluorophenyl)-2,2-dimethyl-4-oxobutyric acid; MFCD01320134
• Molecular Formula: C₁₂H₁₂F₂O₃
• Molecular Weight: 242.22
• CAS Registry Number: 898766-68-2
• SMILES: Fc1cc(cc(F)c1)C(=O)CC(C)(C)C(O)=O
• InChI: 1S/C12H12F2O3/c1-12(2,11(16)17)6-10(15)7-3-8(13)5-9(14)4-7/h3-5H,6H2,1-2H3,(H,16,17)
• InChIKey: OIFCQQPSIVIJDB-UHFFFAOYSA-N

Properties

• Density: 1.274g/cm³ (Cal.)
• Boiling point: 371.206°C at 760 mmHg (Cal.)
• Flash point: 178.299°C (Cal.)
• Refractive index: 1.504 (Cal.)

Safety Data

• Safety Description: IRRITANT, FLAMMABLE