1-(Phenylsulfonyl)-1H-Pyrrolo[2,3-b]Pyridine-3-Carboxylic Acid
[CAS# 245064-80-6]

Identification

• Name: 1-(Phenylsulfonyl)-1H-Pyrrolo[2,3-b]Pyridine-3-Carboxylic Acid
• Synonyms: 1H-Pyrrolo[2,3-b]pyridine-3-carboxylic acid, 1-(phenylsulfonyl)-; 1H-Pyrrolo[2,3-b]pyridine-3-carboxylic acid,1-(phenylsulfonyl)-; 1H-PYRROLO[2,3-B]PYRIDINE-3-CARBOXYLICACID, 1-(PHENYLSULFONYL)-
• Molecular Formula: C₁₄H₁₀N₂O₄S
• Molecular Weight: 302.31
• CAS Registry Number: 245064-80-6
• SMILES: c1ccc(cc1)S(=O)(=O)n2cc(c3c2nccc3)C(=O)O
• InChI: 1S/C14H10N2O4S/c17-14(18)12-9-16(13-11(12)7-4-8-15-13)21(19,20)10-5-2-1-3-6-10/h1-9H,(H,17,18)
• InChIKey: RQSVFGBNWQDWIN-UHFFFAOYSA-N

Properties

• Density: 1.49g/cm³ (Cal.)
• Boiling point: 587.064°C at 760 mmHg (Cal.)
• Flash point: 308.846°C (Cal.)
• Refractive index: 1.694 (Cal.)