2-(3-Methylbenzyl)-3-(methyl{[(2-methyl-2-propanyl)oxy]carbonyl}amino)propanoic acid
[CAS# 886364-81-4]

Identification

• Name: 2-(3-Methylbenzyl)-3-(methyl{[(2-methyl-2-propanyl)oxy]carbonyl}amino)propanoic acid
• Synonyms: 2-[(tert-Butoxycarbonyl-methyl-amino)-methyl]-3-m-tolyl-propionic acid; 2-N-Boc-2-Methylaminomethyl-3-m-tolyl-propionic; 2-N-Boc-2-Methylaminomethyl-3-m-tolyl-propionic acid
• Molecular Formula: C₁₇H₂₅NO₄
• Molecular Weight: 307.38
• CAS Registry Number: 886364-81-4
• SMILES: OC(=O)C(CN(C)C(=O)OC(C)(C)C)Cc1cccc(C)c1
• InChI: 1S/C17H25NO4/c1-12-7-6-8-13(9-12)10-14(15(19)20)11-18(5)16(21)22-17(2,3)4/h6-9,14H,10-11H2,1-5H3,(H,19,20)
• InChIKey: YFZYDUPKZBDVHX-UHFFFAOYSA-N

Properties

• Density: 1.112g/cm³ (Cal.)
• Boiling point: 435.469°C at 760 mmHg (Cal.)
• Flash point: 217.164°C (Cal.)
• Refractive index: 1.524 (Cal.)