Methyl N,1-Bis{[(2-Methyl-2-Propanyl)Oxy]Carbonyl}-L-Histidinate
[CAS# 17791-51-4]

Identification

• Classification: Biochemical >> Amino acids and their derivatives >> Histidine derivative
• Name: Methyl N,1-Bis{[(2-Methyl-2-Propanyl)Oxy]Carbonyl}-L-Histidinate
• Synonyms: [Methyl(S)-3[1-(1,1-dimethylethoxycarbonyl)-1-H-imidaral-4-yl]-2-[(1,1-dimethylethoxycarbonyl)amino]propionate]; N(α), N-(im)-Di-Boc-L-histidine methyl ester; N(α), N-(im)-Di-Boc-L-histidine methyl ester
• Molecular Formula: C₁₇H₂₇N₃O₆
• Molecular Weight: 369.41
• CAS Registry Number: 17791-51-4
• SMILES: O=C(OC(C)(C)C)N[C@H](C(=O)OC)Cc1ncn(C(=O)OC(C)(C)C)c1
• InChI: 1S/C17H27N3O6/c1-16(2,3)25-14(22)19-12(13(21)24-7)8-11-9-20(10-18-11)15(23)26-17(4,5)6/h9-10,12H,8H2,1-7H3,(H,19,22)/t12-/m0/s1
• InChIKey: ZYCZFTGHOVFXLZ-LBPRGKRZSA-N

Properties

• Density: 1.177g/cm³ (Cal.)
• Refractive index: 1.516 (Cal.)