4-Bromo-1-(Piperazin-1-Yl)Isoquinoline
[CAS# 401567-96-2]

Identification

• Name: 4-Bromo-1-(Piperazin-1-Yl)Isoquinoline
• Synonyms: 4-Bromo-1-(Piperazin-1-Yl)Isoquinoline
• Molecular Formula: C₁₃H₁₄BrN₃
• Molecular Weight: 292.18
• CAS Registry Number: 401567-96-2
• SMILES: C1=C(Br)C3=C(C(=N1)N2CCNCC2)C=CC=C3
• InChI: 1S/C13H14BrN3/c14-12-9-16-13(17-7-5-15-6-8-17)11-4-2-1-3-10(11)12/h1-4,9,15H,5-8H2
• InChIKey: OCIYHIDIWCIADH-UHFFFAOYSA-N

Properties

• Density: 1.452g/cm³ (Cal.)
• Boiling point: 463.304°C at 760 mmHg (Cal.)
• Flash point: 233.998°C (Cal.)

Safety Data

• Safety Description: R 36/37/38 S 26-36/37