5-Chloro-N-{[(2-Methyl-2-Propanyl)Oxy]Carbonyl}-L-Tryptophan
[CAS# 114873-08-4]

Identification

• Name: 5-Chloro-N-{[(2-Methyl-2-Propanyl)Oxy]Carbonyl}-L-Tryptophan
• Synonyms: (S)-N-Boc-5-chlorotryptophan; L-N-Boc-5-chlorotryptophan
• Molecular Formula: C₁₆H₁₉ClN₂O₄
• Molecular Weight: 338.79
• CAS Registry Number: 114873-08-4
• SMILES: CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2c1cc(cc2)Cl)C(=O)O
• InChI: 1S/C16H19ClN2O4/c1-16(2,3)23-15(22)19-13(14(20)21)6-9-8-18-12-5-4-10(17)7-11(9)12/h4-5,7-8,13,18H,6H2,1-3H3,(H,19,22)(H,20,21)/t13-/m0/s1
• InChIKey: PZZXAZAYKCNQAL-ZDUSSCGKSA-N

Properties

• Density: 1.339g/cm³ (Cal.)
• Boiling point: 560.777°C at 760 mmHg (Cal.)
• Flash point: 292.947°C (Cal.)
• Refractive index: 1.609 (Cal.)