1-Phospho-2,3-Diketo-5-S-Methylthiopentane
[CAS# 115974-73-7]

Identification

• Name: 1-Phospho-2,3-Diketo-5-S-Methylthiopentane
• Synonyms: (5-Methylsulfanyl-2,3-Dioxo-Pentyl) Dihydrogen Phosphate; [5-(Methylthio)-2,3-Dioxopentyl] Dihydrogen Phosphate; [2,3-Diketo-5-(Methylthio)Pentyl] Dihydrogen Phosphate
• Molecular Formula: C₆H₁₁O₆PS
• Molecular Weight: 242.18
• CAS Registry Number: 115974-73-7
• SMILES: C(C(C(CCSC)=O)=O)O[P](=O)(O)O
• InChI: 1S/C6H11O6PS/c1-14-3-2-5(7)6(8)4-12-13(9,10)11/h2-4H2,1H3,(H2,9,10,11)
• InChIKey: HKEAOVFNWRDVAJ-UHFFFAOYSA-N

Properties

• Density: 1.501g/cm³ (Cal.)
• Boiling point: 413.058°C at 760 mmHg (Cal.)
• Flash point: 203.611°C (Cal.)