Tert-Butyloxycarbonyl-Alanyl-Aminoisobutyryl-Alanyl Methyl Ester
[CAS# 72086-86-3]

Identification

• Name: Tert-Butyloxycarbonyl-Alanyl-Aminoisobutyryl-Alanyl Methyl Ester
• Synonyms: Methyl (2S)-2-[(2-Amino-2-Methyl-Propanoyl)-[(2S)-2-(Tert-Butoxycarbonylamino)Propanoyl]Amino]Propanoate; (2S)-2-[(2-Amino-2-Methyl-1-Oxopropyl)-[(2S)-2-[(Tert-Butoxy-Oxomethyl)Amino]-1-Oxopropyl]Amino]Propanoic Acid Methyl Ester; (2S)-2-[(2-Amino-2-Methyl-Propanoyl)-[(2S)-2-(Tert-Butoxycarbonylamino)Propanoyl]Amino]Propionic Acid Methyl Ester
• Molecular Formula: C₁₆H₂₉N₃O₆
• Molecular Weight: 359.42
• CAS Registry Number: 72086-86-3
• SMILES: [C@H](C(=O)OC)(N(C(C(N)(C)C)=O)C([C@@H](NC(=O)OC(C)(C)C)C)=O)C
• InChI: 1S/C16H29N3O6/c1-9(18-14(23)25-15(3,4)5)11(20)19(10(2)12(21)24-8)13(22)16(6,7)17/h9-10H,17H2,1-8H3,(H,18,23)/t9-,10-/m0/s1
• InChIKey: OTKJKZBLJMXFIO-UWVGGRQHSA-N

Properties

• Density: 1.143g/cm³ (Cal.)
• Boiling point: 480.523°C at 760 mmHg (Cal.)
• Flash point: 244.412°C (Cal.)