2-Ethoxy-N,N-diethyl-5H-1,3-diazepin-4-amine
[CAS# 676577-87-0]

Identification

• Name: 2-Ethoxy-N,N-diethyl-5H-1,3-diazepin-4-amine
• Synonyms: 4-Diethylamino-2-ethoxy-5H-1,3-diazepine
• Molecular Formula: C₁₁H₁₉N₃O
• Molecular Weight: 209.29
• CAS Registry Number: 676577-87-0
• SMILES: CCN(CC)C1=NC(=NC=CC1)OCC
• InChI: 1S/C11H19N3O/c1-4-14(5-2)10-8-7-9-12-11(13-10)15-6-3/h7,9H,4-6,8H2,1-3H3
• InChIKey: LHESECUZCFENGB-UHFFFAOYSA-N

Properties

• Density: 1.0±0.1g/cm³ (Cal.)
• Boiling point: 285.5±33.0°C at 760 mmHg (Cal.)
• Flash point: 126.4±25.4°C (Cal.)
• Refractive index: 1.512 (Cal.)

References

• (1): Ales Reisinger, Paul V. Bernhardt and Curt Wentrup. Synthesis of 1,3-diazepines and ring contraction to cyanopyrroles, Org. Biomol. Chem., 2004, 2, 246.