4-(Trifluoromethylthio)phenol


Catalog No:   FT-0602468

CAS No:   461-84-7

  • Molecular Formula:  194.18
  • Formula Weight: C7H5F3OS
  • Inchl Key: YYCPTWHVKSATQK-UHFFFAOYSA-N
  • Inchl: InChI=1S/C7H5F3OS/c8-7(9,10)12-6-3-1-5(11)2-4-6/h1-4,11H

Assay Pack Price Stock Action
98% 1g N/A N/A
98% 5g N/A N/A
98% Bulk Quantity N/A N/A
Symbol: GHS07
CAS: 461-84-7
Flash_Point: 56.9±27.3 °C
Product_Name: 4-[(Trifluoromethyl)sulfanyl]phenol
Bolling_Point: 170.4±40.0 °C at 760 mmHg
FW: 194.174
Melting_Point: 57-60 °C(lit.)
MF: C7H5F3OS
Density: 1.5±0.1 g/cm3
Refractive_Index: 1.529
Vapor_Pressure: 1.1±0.3 mmHg at 25°C
Flash_Point: 56.9±27.3 °C
LogP: 2.67
Bolling_Point: 170.4±40.0 °C at 760 mmHg
PSA: 45.53000
Molecular_Structure: ['1 . Molar refractive index 4128 ', '2 . Molar volume (m3/mol)1338 ', '3 . Parachor (902K)3349 ', '4 . Surface tension 392 ', '5 . Polarizability (10 -24cm 3)1636']
Computational_Chemistry: ['1. XlogP :33 ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :5 ', '4. Rotatable Bond Count :1 ', '5. Isotope Atom Count :2 ', '6. TPSA 455 ', '7. Heavy Atom Count :12 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :140 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :0 ', '12. Undefined Atom Stereocenter Count :0 ', '13. Defined Bond Stereocenter Count :0 ', '14. Undefined Bond Stereocenter Count :0 ', '15. Covalently-Bonded Unit Count :1']
Melting_Point: 57-60 °C(lit.)
MF: C7H5F3OS
Exact_Mass: 194.001312
FW: 194.174
Density: 1.5±0.1 g/cm3
More_Info: ['1 . Appearance Unknow ', '2 . Density(g/ m3,25/4℃)145 ', '3 . Relative vapor density(g/cm3,Atmosphere =1)Unknow ', '4 . Melting point(ºC)Unknow ', '5 . Boiling point(ºC,Atmospheric pressure)77-78 ', '6 . Boiling point(ºC,52kPa)Unknow ', '7 . Refractive indexUnknow ', '8 . Flash point(ºC)57 ', '9 . Specific rotation(º)Unknow ', '10 . Spontaneous ignition point or ignition temperature(ºC)Unknow ', '11 . Vapor pressure(kPa,25ºC)Unknow ', '12 . Saturated vapor pressure(kPa,60ºC)Unknow ', '13 . Combustion heat(KJ/mol)Unknow ', '14 . Critical temperature(ºC)Unknow ', '15 . Critical pressure(KPa)Unknow ', '16 . Oil-water(Octanol /Water )Logarithmic Value of Distribution Coefficient Unknow ', '17 . Upper limit of explosion(%,V/V)Unknow ', '18 . Lower limit of explosion(%,V/V)Unknow ', '19 . Solubility Unknow']
Symbol: GHS07
Risk_Statements(EU): R36/37/38
HS_Code: 2930909090
WGK_Germany: 3
Personal_Protective_Equipment: dust mask type N95 (US);Eyeshields;Gloves
RIDADR: NONH for all modes of transport
Hazard_Codes: Xi:Irritant;
Warning_Statement: P261-P305 + P351 + P338
Safety_Statements: H315-H319-H335

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