Methyl 3-bromo-6-(trifluoromethyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxylate
[CAS 952800-37-2]

Identification

• Name: Methyl 3-bromo-6-(trifluoromethyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxylate
• Synonyms: Methyl 3-bromo-6-(trifluoromethyl)-1H-pyrrolo[2,3 - b]pyridine-2-carboxylate; Methyl 3-bromo-6-(trifluoromethyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxylate; Methyl 3-bromo-6-(trifluoromethyl)-7-azaindole-2-carboxylate
• Molecular Formula: C₁₀H₆BrF₃N₂O₂
• Molecular Weight: 323.07
• CAS Registry Number: 952800-37-2
• SMILES: COC(=O)c1c(c2ccc(nc2[nH]1)C(F)(F)F)Br
• InChI: 1S/C10H6BrF3N2O2/c1-18-9(17)7-6(11)4-2-3-5(10(12,13)14)15-8(4)16-7/h2-3H,1H3,(H,15,16)
• InChIKey: XRVMZHISSGDOPE-UHFFFAOYSA-N

Properties

• Density: 1.768g/cm³ (Cal.)
• Boiling point: 374.485°C at 760 mmHg (Cal.)
• Flash point: 180.282°C (Cal.)
• Refractive index: 1.583 (Cal.)

Safety Data

• Safety Description: S6,S7,S22,S24/25,S36/37/39,S45