4-Chloro-2-(3,4,5-trimethoxyphenyl)-1H-pyrrolo[2,3-b]pyridine 7-oxide
[CAS# 913698-80-3]

Identification

• Name: 4-Chloro-2-(3,4,5-trimethoxyphenyl)-1H-pyrrolo[2,3-b]pyridine 7-oxide
• Synonyms: 1H-Pyrrolo[2,3-b]pyridine, 4-chloro-2-(3,4,5-trimethoxyphenyl)-, 7-oxide
• Molecular Formula: C₁₆H₁₅ClN₂O₄
• Molecular Weight: 334.75
• CAS Registry Number: 913698-80-3
• SMILES: COc1cc(cc(OC)c1OC)c2cc3c(Cl)cc[n+]([O-])c3n2
• InChI: 1S/C16H15ClN2O4/c1-21-13-6-9(7-14(22-2)15(13)23-3)12-8-10-11(17)4-5-19(20)16(10)18-12/h4-8,18H,1-3H3
• InChIKey: GSUOYPJMLCRDSN-UHFFFAOYSA-N

Properties

• Density: 1.374g/cm³ (Cal.)
• Boiling point: 531.908°C at 760 mmHg (Cal.)
• Flash point: 275.488°C (Cal.)
• Refractive index: 1.612 (Cal.)