3-Amino-3-[2-(3-chlorophenyl)-5-pyrimidinyl]propanoic acid
[CAS# 928713-13-7]

Identification

• Name: 3-Amino-3-[2-(3-chlorophenyl)-5-pyrimidinyl]propanoic acid
• Molecular Formula: C₁₃H₁₂ClN₃O₂
• Molecular Weight: 277.71
• CAS Registry Number: 928713-13-7
• SMILES: c1cc(cc(c1)Cl)c2ncc(cn2)C(CC(=O)O)N
• InChI: 1S/C13H12ClN3O2/c14-10-3-1-2-8(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: CQXGHYBSDDUCJA-UHFFFAOYSA-N

Properties

• Density: 1.378g/cm³ (Cal.)
• Boiling point: 404.382°C at 760 mmHg (Cal.)
• Flash point: 198.363°C (Cal.)
• Refractive index: 1.624 (Cal.)