3-(3-Methoxyphenyl)-3-({[(2-Methyl-2-Propanyl)Oxy]Carbonyl}Amino)Propanoic Acid
[CAS# 499995-77-6]

Identification

• Name: 3-(3-Methoxyphenyl)-3-({[(2-Methyl-2-Propanyl)Oxy]Carbonyl}Amino)Propanoic Acid
• Synonyms: (R)-3-((tert-Butoxycarbonyl)amino)-3-(3-methoxyphenyl)propanoic acid; (S)-3-((tert-Butoxycarbonyl)amino)-3-(3-methoxyphenyl)propanoic acid; 3-((tert-butoxycarbonyl)amino)-3-(3-methoxyphenyl)propanoic acid
• Molecular Formula: C₁₅H₂₁NO₅
• Molecular Weight: 295.33
• CAS Registry Number: 499995-77-6
• SMILES: CC(C)(C)OC(=O)NC(CC(=O)O)C1=CC(=CC=C1)OC
• InChI: 1S/C15H21NO5/c1-15(2,3)21-14(19)16-12(9-13(17)18)10-6-5-7-11(8-10)20-4/h5-8,12H,9H2,1-4H3,(H,16,19)(H,17,18)
• InChIKey: DNXONWHJJNOKEU-UHFFFAOYSA-N

Properties

• Density: 1.2±0.1g/cm³ (Cal.)
• Melting point: 81-83°C (Expl.)
• Boiling point: 458.5±45.0°C at 760 mmHg (Cal.)
• Flash point: 231.1±28.7°C (Cal.)
• Refractive index: 1.522 (Cal.)

Safety Data

• Safety Description: IRRITANT