3-Amino-3-(4-fluoro-1H-indol-3-yl)propanoic acid
[CAS# 887586-26-7]

Identification

• Name: 3-Amino-3-(4-fluoro-1H-indol-3-yl)propanoic acid
• Synonyms: 1H-Indole-3-propanoic acid, β-amino-4-fluoro-; 1H-INDOLE-3-PROPANOICACID, B-AMINO-4-FLUORO-; 3-Amino-3-(4-fluor-1H-indol-3-yl)propansäure
• Molecular Formula: C₁₁H₁₁FN₂O₂
• Molecular Weight: 222.22
• CAS Registry Number: 887586-26-7
• SMILES: c1cc2c(c(c1)F)c(c[nH]2)C(CC(=O)O)N
• InChI: 1S/C11H11FN2O2/c12-7-2-1-3-9-11(7)6(5-14-9)8(13)4-10(15)16/h1-3,5,8,14H,4,13H2,(H,15,16)
• InChIKey: RTNFFLRJNDBXGO-UHFFFAOYSA-N

Properties

• Density: 1.4±0.1g/cm³ (Cal.)
• Boiling point: 450.7±45.0°C at 760 mmHg (Cal.)
• Flash point: 226.4±28.7°C (Cal.)
• Refractive index: 1.672 (Cal.)