4-Propyl-2,6,7-Trioxa-1-Phosphabicyclo[2.2.2]Octane-1-Thione
[CAS# 51486-54-5]

Identification

• Name: 4-Propyl-2,6,7-Trioxa-1-Phosphabicyclo[2.2.2]Octane-1-Thione
• Synonyms: 4-Propyl-1-Thioxo-2,6,7-Trioxa-1$L^{5}-Phosphabicyclo[2.2.2]Octane; 1,3-Propanediol, 2-(Hydroxymethyl)-2-Propyl-, Cyclic Phosphorothioate (1:1); 2,6,7-Trioxa-1-Phosphabicyclo(2.2.2)Octane, 4-Propyl-, 1-Sulfide
• Molecular Formula: C₇H₁₃O₃PS
• Molecular Weight: 208.21
• CAS Registry Number: 51486-54-5
• SMILES: C(C)CC12CO[P](=S)(OC1)OC2
• InChI: 1S/C7H13O3PS/c1-2-3-7-4-8-11(12,9-5-7)10-6-7/h2-6H2,1H3
• InChIKey: TVWURRDFHQMXFZ-UHFFFAOYSA-N

Properties

• Density: 1.297g/cm³ (Cal.)
• Boiling point: 225.184°C at 760 mmHg (Cal.)
• Flash point: 89.988°C (Cal.)