Methyl (5-bromo-2-cyanophenyl)(cyano)acetate
[CAS# 925672-87-3]

Identification

• Name: Methyl (5-bromo-2-cyanophenyl)(cyano)acetate
• Synonyms: 5-Bromo-a,2-dicyanobenzeneacetic acid methyl ester
• Molecular Formula: C₁₁H₇BrN₂O₂
• Molecular Weight: 279.09
• CAS Registry Number: 925672-87-3
• SMILES: COC(=O)C(C#N)C1=C(C=CC(=C1)Br)C#N
• InChI: 1S/C11H7BrN2O2/c1-16-11(15)10(6-14)9-4-8(12)3-2-7(9)5-13/h2-4,10H,1H3
• InChIKey: DLORCFNKNRMRFO-UHFFFAOYSA-N

Properties

• Density: 1.6±0.1g/cm³ (Cal.)
• Boiling point: 419.3±45.0°C at 760 mmHg (Cal.)
• Flash point: 207.4±28.7°C (Cal.)
• Refractive index: 1.588 (Cal.)