(1S)-2-(2-Pyrimidinyl)-2,5-Diazabicyclo[2.2.1]Heptane
[CAS# 133982-56-6]

Identification

• Name: (1S)-2-(2-Pyrimidinyl)-2,5-Diazabicyclo[2.2.1]Heptane
• Synonyms: (1S)-2-(pyrimidin-2-yl)-2,5-diazabicyclo[2.2.1]heptane
• Molecular Formula: C₉H₁₂N₄
• Molecular Weight: 176.22
• CAS Registry Number: 133982-56-6
• SMILES: C1[C@H]2CNC1CN2C3=NC=CC=N3
• InChI: 1S/C9H12N4/c1-2-10-9(11-3-1)13-6-7-4-8(13)5-12-7/h1-3,7-8,12H,4-6H2/t7?,8-/m0/s1
• InChIKey: MRJLWJGWYVMTGW-MQWKRIRWSA-N

Properties

• Density: 1.2±0.1g/cm³ (Cal.)
• Boiling point: 350.5±52.0°C at 760 mmHg (Cal.)
• Flash point: 165.8±30.7°C (Cal.)
• Refractive index: 1.596 (Cal.)