H-Glu(4m-betana)-OH

Chemical Properties

Boiling point	607.9±55.0 °C(Predicted)
Density	1.321±0.06 g/cm3(Predicted)
storage temp.	−20°C
solubility	1 N HCl: ethanol, 1:1: 25mg/mL, clear, colorless to faintly yellow
form	powder
pka	2.21±0.10(Predicted)
color	White to off-white
InChI	1S/C16H18N2O4/c1-22-14-9-11(8-10-4-2-3-5-12(10)14)18-15(19)7-6-13(17)16(20)21/h2-5,8-9,13H,6-7,17H2,1H3,(H,18,19)(H,20,21)
InChIKey	DUNDTSUHZJULAX-UHFFFAOYSA-N
SMILES	OC([C@@H](N)CCC(NC1=CC2=CC=CC=C2C(OC)=C1)=O)=O