4-(TRIFLUOROMETHYL)PHENYLACETONITRILE


Catalog No:   FT-0616936

CAS No:   2338-75-2

  • Molecular Formula:  185.15
  • Formula Weight: C9H6F3N
  • Inchl Key: QNKOCFJZJWOXDE-UHFFFAOYSA-N
  • Inchl: InChI=1S/C9H6F3N/c10-9(11,12)8-3-1-7(2-4-8)5-6-13/h1-4H,5H2

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: 2338-75-2
Flash_Point: 90.3±25.9 °C
Product_Name: 4-(Trifluoromethyl)phenylacetonitrile
Bolling_Point: 246.0±0.0 °C at 760 mmHg
FW: 185.146
Melting_Point: 47-49 °C(lit.)
MF: C9H6F3N
Density: 1.2±0.1 g/cm3
Refractive_Index: 1.458
Vapor_Pressure: 0.0±0.5 mmHg at 25°C
Flash_Point: 90.3±25.9 °C
LogP: 2.02
Bolling_Point: 246.0±0.0 °C at 760 mmHg
PSA: 23.79000
Molecular_Structure: ['1 . Molar refractive index 4069 ', '2 . Molar volume (m3/mol)1491 ', '3 . Parachor (902K)3493 ', '4 . Surface tension 301 ', '5 . Polarizability (10 -24cm 3)1613']
Computational_Chemistry: ['1. XlogP :25 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :4 ', '4. Rotatable Bond Count :1 ', '5. Isotope Atom Count :N/A ', '6. TPSA 238 ', '7. Heavy Atom Count :13 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :205 ', '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: 47-49 °C(lit.)
MF: C9H6F3N
Exact_Mass: 185.045227
FW: 185.146
Density: 1.2±0.1 g/cm3
More_Info: ['1 . Appearance 带White 的晶体 ', '2 . Density(g/L,20ºC)123 ', '3 . Relative vapor density(g/mL,Atmosphere =1)Unknow ', '4 . Melting point(ºC)43-47 ', '5 . Boiling point(ºC,Atmospheric pressure)Unknow ', '6 . Boiling point(ºC 20mmHg)131-132 ', '7 . Refractive index(nD20)Unknow ', '8 . Flash point(ºF)>230 ', '9 . Specific rotation()Unknow ', '10 . Spontaneous ignition point or ignition temperature(ºC)>110 ', '11 . Vapor pressure(Pa,25ºC)Unknow ', '12 . Saturated vapor pressure(kPa,20ºC)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 不能溶解的']
Symbol: GHS07
RIDADR: 3439
HS_Code: 2926909090
Packing_Group: III
Hazard_Class: 6.1
Risk_Statements(EU): R20/21/22;R36/37/38
WGK_Germany: 3
Personal_Protective_Equipment: dust mask type N95 (US);Eyeshields;Gloves
Hazard_Codes: Xn:Harmful;
Warning_Statement: P261-P280-P305 + P351 + P338
Safety_Statements: H302 + H312 + H332-H315-H319-H335

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