Betiatide
[CAS# 103725-47-9]

Identification

• Name: Betiatide
• Synonyms: 2-[[1-Oxo-2-[[1-Oxo-2-[[1-Oxo-2-[(Oxo-Phenylmethyl)Thio]Ethyl]Amino]Ethyl]Amino]Ethyl]Amino]Acetic Acid; 2-[[2-[[2-[[2-(Benzoylthio)Acetyl]Amino]Acetyl]Amino]Acetyl]Amino]Acetic Acid; 2-[2-[2-(2-Phenylcarbonylsulfanylethanoylamino)Ethanoylamino]Ethanoylamino]Ethanoic Acid
• Molecular Formula: C₁₅H₁₇N₃O₆S
• Molecular Weight: 367.38
• CAS Registry Number: 103725-47-9
• SMILES: C1=C(C(SCC(=O)NCC(=O)NCC(=O)NCC(=O)O)=O)C=CC=C1
• InChI: 1S/C15H17N3O6S/c19-11(16-6-12(20)18-8-14(22)23)7-17-13(21)9-25-15(24)10-4-2-1-3-5-10/h1-5H,6-9H2,(H,16,19)(H,17,21)(H,18,20)(H,22,23)
• InChIKey: VDPYMEBVIDZKMD-UHFFFAOYSA-N

Properties

• Density: 1.397g/cm³ (Cal.)
• Boiling point: 798.495°C at 760 mmHg (Cal.)
• Flash point: 436.714°C (Cal.)