2-Methyl-2-propanyl 5-chloro-3-iodo-1H-pyrrolo[2,3-b]pyridine-1-carboxylate
[CAS# 928653-79-6]

Identification

• Name: 2-Methyl-2-propanyl 5-chloro-3-iodo-1H-pyrrolo[2,3-b]pyridine-1-carboxylate
• Synonyms: 5-Chloro-3-iodo-pyrrolo[2,3-b]pyridine-1-carboxylic acid tert-butyl ester; 5-CHLORO-3-IODO-PYRROLO[2,3-B]PYRIDINE-1-CARBOXYLICACIDTERT-BUTYLESTER; tert-butyl 5-chloro-3-iodo-1H-pyrrolo[2,3-b]pyridine-1-carboxylate
• Molecular Formula: C₁₂H₁₂ClIN₂O₂
• Molecular Weight: 378.59
• CAS Registry Number: 928653-79-6
• SMILES: CC(C)(C)OC(=O)n2cc(I)c1cc(Cl)cnc12
• InChI: 1S/C12H12ClIN2O2/c1-12(2,3)18-11(17)16-6-9(14)8-4-7(13)5-15-10(8)16/h4-6H,1-3H3
• InChIKey: FHBLBHBXDKLIJN-UHFFFAOYSA-N

Properties

• Density: 1.738g/cm³ (Cal.)
• Boiling point: 413.636°C at 760 mmHg (Cal.)
• Flash point: 203.96°C (Cal.)
• Refractive index: 1.647 (Cal.)

Safety Data

• Safety Description: IRRITANT