2-(3-Methoxybenzyl)-3-(methyl{[(2-methyl-2-propanyl)oxy]carbonyl}amino)propanoic acid
[CAS# 886364-83-6]

Identification

• Name: 2-(3-Methoxybenzyl)-3-(methyl{[(2-methyl-2-propanyl)oxy]carbonyl}amino)propanoic acid
• Synonyms: 2-[(tert-Butoxycarbonyl-methyl-amino)-methyl]-3-(3-methoxy-phenyl)-propionic acid; 2-N-Boc-3-(3-Methoxy-phenyl)-2-methylaminomethyl-; 2-N-Boc-3-(3-Methoxy-phenyl)-2-methylaminomethyl-propionic acid
• Molecular Formula: C₁₇H₂₅NO₅
• Molecular Weight: 323.38
• CAS Registry Number: 886364-83-6
• SMILES: COc1cc(CC(CN(C)C(=O)OC(C)(C)C)C(O)=O)ccc1
• InChI: 1S/C17H25NO5/c1-17(2,3)23-16(21)18(4)11-13(15(19)20)9-12-7-6-8-14(10-12)22-5/h6-8,10,13H,9,11H2,1-5H3,(H,19,20)
• InChIKey: XFNSPQTTYJTYEQ-UHFFFAOYSA-N

Properties

• Density: 1.138g/cm³ (Cal.)
• Boiling point: 455.53°C at 760 mmHg (Cal.)
• Flash point: 229.297°C (Cal.)
• Refractive index: 1.521 (Cal.)