(2-Phenylpropan-2-yloxy)(trifluoromethyl)sulfane

• Catalog: OFC1640084145-1
• CAS: 1640084-14-5
• Category: Trifluoromethylthiolation Agents
• Purity: 98%
• MDL Number: MFCD30187371

• IUPAC Name: 2-(trifluoromethylsulfanyloxy)propan-2-ylbenzene
• InChI: InChI=1S/C10H11F3OS/c1-9(2,14-15-10(11,12)13)8-6-4-3-5-7-8/h3-7H,1-2H3
• InChI Key: VYAJORZDVDXTAC-UHFFFAOYSA-N
• Isomeric SMILES: CC(C)(C1=CC=CC=C1)OSC(F)(F)F

• Molecular Formula: C10H11F3OS
• Molecular Weight: 236.25
• Storage: Keep in dark place, inert atmosphere; Store in freezer, under -20°C

• XLogP3-AA: 3.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 236.04827063 g/mol
• Monoisotopic Mass: 236.04827063 g/mol
• Topological Polar Surface Area: 34.5Ų
• Heavy Atom Count: 15
• Formal Charge: 0
• Complexity: 197