Selenobiotin
[CAS 57956-29-3]

Identification

• Name: Selenobiotin
• Synonyms: 5-[(3Ar,6S,6As)-2-Keto-1,3,3A,4,6,6A-Hexahydroselenopheno[3,4-D]Imidazol-6-Yl]Valeric Acid; 1H-Selenolo(3,4-D)Imidazole-4-Pentanoic Acid, Hexahydro-2-Oxo-, (3As-(3Aalpha,4Beta,6Aalpha))-; Selenobiotin
• Molecular Formula: C₁₀H₁₆N₂O₃Se
• Molecular Weight: 291.21
• CAS Registry Number: 57956-29-3
• SMILES: [C@@H]12NC(N[C@@H]1[C@@H]([Se]C2)CCCCC(=O)O)=O
• InChI: 1S/C10H16N2O3Se/c13-8(14)4-2-1-3-7-9-6(5-16-7)11-10(15)12-9/h6-7,9H,1-5H2,(H,13,14)(H2,11,12,15)/t6-,7-,9-/m0/s1
• InChIKey: HVUDXAKXEONARI-ZKWXMUAHSA-N

Properties

• Boiling point: 579.662°C at 760 mmHg (Cal.)
• Flash point: 304.369°C (Cal.)