calcium 4-[4-(2,4-difluorophenyl)phenyl]-2-methyl-4-oxo-butanoate

• CAT Number: M043257
• CAS Number: 161692-92-8
• Molecular Formula: C34H26CaF4O6
• Molecular Weight: 646.648
• Purity: ≥95%
• Synonyms: calcium 4-[4-(2,4-difluorophenyl)phenyl]-2-methyl-4-oxo-butanoate
• Storage: Store at -20°C
• IUPAC Name: calcium;4-[4-(2,4-difluorophenyl)phenyl]-2-methyl-4-oxobutanoate
• InChI: InChI=1S/2C17H14F2O3.Ca/c2*1-10(17(21)22)8-16(20)12-4-2-11(3-5-12)14-7-6-13(18)9-15(14)19;/h2*2-7,9-10H,8H2,1H3,(H,21,22);/q;;+2/p-2
• InChIKey: RGGUNEDYCJDNNU-UHFFFAOYSA-L
• SMILES: CC(CC(=O)C1=CC=C(C=C1)C2=C(C=C(C=C2)F)F)C(=O)[O-].CC(CC(=O)C1=CC=C(C=C1)C2=C(C=C(C=C2)F)F)C(=O)[O-].[Ca+2]