1-(2-Methyl-2-Propanyl)-1H-Pyrrole
[CAS# 24764-40-7]

Identification

• Name: 1-(2-Methyl-2-Propanyl)-1H-Pyrrole
• Synonyms: 1-(tert-butyl)-1H-pyrrole; 1H-Pyrrole,2-(1,1-dimethylethyl)-; 1-tert-Butyl-1H-pyrrole #
• Molecular Formula: C₈H₁₃N
• Molecular Weight: 123.20
• CAS Registry Number: 24764-40-7
• SMILES: CC(C)(C)N1C=CC=C1
• InChI: 1S/C8H13N/c1-8(2,3)9-6-4-5-7-9/h4-7H,1-3H3
• InChIKey: GJIRIQBRSTYPSF-UHFFFAOYSA-N

Properties

• Density: 0.8±0.1g/cm³ (Cal.)
• Boiling point: 156.4±9.0°C at 760 mmHg (Cal.)
• Flash point: 48.4±18.7°C (Cal.)
• Refractive index: 1.471 (Cal.)

Safety Data

• Safety Description: IRRITANT

References

• (1): Xiaoxi Zhao and Douglas W. Stephan. Frustrated Lewis pair olefin addition reactions: P-, N-, C- and H-based nucleophilic additions to an olefin-tethered borane, Chem. Sci., 2012, 3, 2123.