2-Methyl-2-Propanyl {4-[(1,1-Difluoroethyl)Sulfanyl]Phenyl}Carbamate
[CAS# 554412-18-9]

Identification

• Name: 2-Methyl-2-Propanyl {4-[(1,1-Difluoroethyl)Sulfanyl]Phenyl}Carbamate
• Synonyms: tert-butyl (4-((1,1-difluoroethyl)thio)phenyl)carbamate; ZINC03296974
• Molecular Formula: C₁₃H₁₇F₂NO₂S
• Molecular Weight: 289.34
• CAS Registry Number: 554412-18-9
• SMILES: FC(F)(Sc1ccc(cc1)NC(=O)OC(C)(C)C)C
• InChI: 1S/C13H17F2NO2S/c1-12(2,3)18-11(17)16-9-5-7-10(8-6-9)19-13(4,14)15/h5-8H,1-4H3,(H,16,17)
• InChIKey: MARADABQZJOCRS-UHFFFAOYSA-N

Properties

• Density: 1.202g/cm³ (Cal.)
• Boiling point: 294.223°C at 760 mmHg (Cal.)
• Flash point: 131.742°C (Cal.)
• Refractive index: 1.518 (Cal.)