3-Amino-3-[2-(4-bromophenyl)-5-pyrimidinyl]propanoic acid
[CAS# 928713-90-0]

Identification

• Name: 3-Amino-3-[2-(4-bromophenyl)-5-pyrimidinyl]propanoic acid
• Molecular Formula: C₁₃H₁₂BrN₃O₂
• Molecular Weight: 322.16
• CAS Registry Number: 928713-90-0
• SMILES: c1cc(ccc1c2ncc(cn2)C(CC(=O)O)N)Br
• InChI: 1S/C13H12BrN3O2/c14-10-3-1-8(2-4-10)13-16-6-9(7-17-13)11(15)5-12(18)19/h1-4,6-7,11H,5,15H2,(H,18,19)
• InChIKey: UVCMAKVEJDKWKD-UHFFFAOYSA-N

Properties

• Density: 1.566g/cm³ (Cal.)
• Boiling point: 409.153°C at 760 mmHg (Cal.)
• Flash point: 201.249°C (Cal.)
• Refractive index: 1.638 (Cal.)