1-Dimethylaminonaphthalene-5-Sulfonyl-D-Tryptophan Ethyl Ester
[CAS# 4982-85-8]

Identification

• Name: 1-Dimethylaminonaphthalene-5-Sulfonyl-D-Tryptophan Ethyl Ester
• Synonyms: Ethyl (2R)-2-[(5-Dimethylamino-1-Naphthyl)Sulfonylamino]-3-(1H-Indol-3-Yl)Propanoate; (2R)-2-[(5-Dimethylamino-1-Naphthyl)Sulfonylamino]-3-(1H-Indol-3-Yl)Propanoic Acid Ethyl Ester; (2R)-2-[(5-Dimethylamino-1-Naphthyl)Sulfonylamino]-3-(1H-Indol-3-Yl)Propionic Acid Ethyl Ester
• Molecular Formula: C₂₅H₂₇N₃O₄S
• Molecular Weight: 465.57
• CAS Registry Number: 4982-85-8
• SMILES: [C@@H](C(=O)OCC)(N[S](=O)(=O)C1=C2C(=CC=C1)C(=CC=C2)N(C)C)CC3=C[NH]C4=CC=CC=C34
• InChI: 1S/C25H27N3O4S/c1-4-32-25(29)22(15-17-16-26-21-12-6-5-9-18(17)21)27-33(30,31)24-14-8-10-19-20(24)11-7-13-23(19)28(2)3/h5-14,16,22,26-27H,4,15H2,1-3H3/t22-/m1/s1
• InChIKey: UKYBNRUEDNIMRV-JOCHJYFZSA-N

Properties

• Density: 1.311g/cm³ (Cal.)
• Boiling point: 678.22°C at 760 mmHg (Cal.)
• Flash point: 363.974°C (Cal.)