5-({[(2-Methyl-2-propanyl)oxy]carbonyl}amino)-1H-pyrrole-3-carboxylic acid
[CAS# 903094-18-8]

Identification

• Name: 5-({[(2-Methyl-2-propanyl)oxy]carbonyl}amino)-1H-pyrrole-3-carboxylic acid
• Synonyms: 5-((tert-butoxycarbonyl)amino)-1H-pyrrole-3-carboxylic acid; 5-TERT-BUTOXYCARBONYLAMINO-1H-PYRROLE-3-CARBOXYLIC ACID
• Molecular Formula: C₁₀H₁₄N₂O₄
• Molecular Weight: 226.23
• CAS Registry Number: 903094-18-8
• SMILES: CC(C)(C)OC(=O)Nc1cc(c[nH]1)C(=O)O
• InChI: 1S/C10H14N2O4/c1-10(2,3)16-9(15)12-7-4-6(5-11-7)8(13)14/h4-5,11H,1-3H3,(H,12,15)(H,13,14)
• InChIKey: QKVKUTZHFYGHKV-UHFFFAOYSA-N

Properties

• Density: 1.336g/cm³ (Cal.)
• Boiling point: 373.978°C at 760 mmHg (Cal.)
• Flash point: 179.976°C (Cal.)
• Refractive index: 1.595 (Cal.)