N-Boc-Nle-Leu-Phe-OH
[CAS# 77542-87-1]

Identification

• Name: N-Boc-Nle-Leu-Phe-OH
• Synonyms: 3-[2-(2-Amino-4-Methyl-Pentanoyl)Phenyl]-2-[2-(Tert-Butoxycarbonylamino)Hexanoylamino]Propanoic Acid; 3-[2-(2-Amino-4-Methyl-1-Oxopentyl)Phenyl]-2-[[2-[(Tert-Butoxy-Oxomethyl)Amino]-1-Oxohexyl]Amino]Propanoic Acid; 3-[2-(2-Amino-4-Methyl-Pentanoyl)Phenyl]-2-[2-(Tert-Butoxycarbonylamino)Hexanoylamino]Propionic Acid
• Molecular Formula: C₂₆H₄₁N₃O₆
• Molecular Weight: 491.63
• CAS Registry Number: 77542-87-1
• SMILES: C1=CC=CC(=C1C(=O)C(N)CC(C)C)CC(NC(=O)C(NC(OC(C)(C)C)=O)CCCC)C(=O)O
• InChI: 1S/C26H41N3O6/c1-7-8-13-20(29-25(34)35-26(4,5)6)23(31)28-21(24(32)33)15-17-11-9-10-12-18(17)22(30)19(27)14-16(2)3/h9-12,16,19-21H,7-8,13-15,27H2,1-6H3,(H,28,31)(H,29,34)(H,32,33)
• InChIKey: PPVKXVMVRRKHLS-UHFFFAOYSA-N

Properties

• Density: 1.128g/cm³ (Cal.)
• Boiling point: 699.748°C at 760 mmHg (Cal.)
• Flash point: 376.994°C (Cal.)