Product Name

  • Name

    DI-TERT-BUTYLSILYL BIS(TRIFLUOROMETHANESULFONATE)

  • EINECS 680-172-7
  • CAS No. 85272-31-7
  • Article Data2
  • CAS DataBase
  • Density 1.389 g/cm3
  • Solubility
  • Melting Point
  • Formula C10H18F6O6S2Si
  • Boiling Point 275.6 °C at 760 mmHg
  • Molecular Weight 440.457
  • Flash Point 140.3 °C
  • Transport Information UN 3265 8/PG 2
  • Appearance
  • Safety 26-36/37/39-45
  • Risk Codes 34
  • Molecular Structure Molecular Structure of 85272-31-7 (DI-TERT-BUTYLSILYL BIS(TRIFLUOROMETHANESULFONATE))
  • Hazard Symbols
  • Synonyms TRIFLUOROMETHANESULFONIC ACID DI-TERT-BUTYLSILYLENE ESTER;DI-T-BUTYLSILYLBIS(TRIFLUOROMETHANESULFONATE);DI(T-BUTYL)SILYL BIS(TRIFLUOROMETHANESULPHONATE);DI-T-BUTYLSILYL DITRIFLATE;DI-TERT-BUTYLBIS(TRIFLUOROMETHANESULFONYLOXY)SILANE;DI-TERT-BUTYLSILYL BIS(TRIFLUOROMETHANESULFONATE);DI-TERT-BUTYLSILYL BIS(TRIFLUOROMETHANESULPHONATE);DI-TERT-BUTYLSILYL DITRIFLATE
  • PSA 103.50000
  • LogP 5.92280

Di-tert-butylsilyl bis(trifluoromethanesulfonate) Specification

The Di-tert-butylsilyl bis(trifluoromethanesulfonate) with its cas register number is 85272-31-7. It also can be called as Methanesulfonic acid,1,1,1-trifluoro-, bis(1,1-dimethylethyl)[[(trifluoromethyl)sulfonyl]oxy]silylester and the Systematic name about this chemical is di-tert-butylsilanediyl bis(trifluoromethanesulfonate). It belongs to the following product categories, such as Si (Classes of Silicon Compounds), Silicon Compounds (for Synthesis), Silyl Esters, Si-O Compounds, Synthetic Organic Chemistry and so on.

Physical properties about Di-tert-butylsilyl bis(trifluoromethanesulfonate) are: (1)ACD/LogP: 6.36; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 6.36; (4)ACD/LogD (pH 7.4): 6.36; (5)ACD/BCF (pH 5.5): 40194.14; (6)ACD/BCF (pH 7.4): 40194.14; (7)ACD/KOC (pH 5.5): 68745.31; (8)ACD/KOC (pH 7.4): 68745.31; (9)#H bond acceptors: 6; (10)#Freely Rotating Bonds: 6; (11)Polar Surface Area: 103.5Å2; (12)Index of Refraction: 1.412; (13)Molar Refractivity: 78.96 cm3; (14)Molar Volume: 317 cm3; (15)Polarizability: 31.3x10-24cm3; (16)Surface Tension: 28.4 dyne/cm; (17)Enthalpy of Vaporization: 49.34 kJ/mol; (18)Vapour Pressure: 0.00846 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
This chemical can causes burns. When you are using it, wear suitable protective clothing, gloves and eye/face protection. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice and in case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.)

You can still convert the following datas into molecular structure:
(1)SMILES: O=S(=O)(O[Si](OS(=O)(=O)C(F)(F)F)(C(C)(C)C)C(C)(C)C)C(F)(F)F
(2)InChI: InChI=1/C10H18F6O6S2Si/c1-7(2,3)25(8(4,5)6,21-23(17,18)9(11,12)13)22-24(19,20)10(14,15)16/h1-6H3
(3)InChIKey: HUHKPYLEVGCJTG-UHFFFAOYAO
(4)Std. InChI: InChI=1S/C10H18F6O6S2Si/c1-7(2,3)25(8(4,5)6,21-23(17,18)9(11,12)13)22-24(19,20)10(14,15)16/h1-6H3
(5)Std. InChIKey: HUHKPYLEVGCJTG-UHFFFAOYSA-N

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