3,5-Dimethylphenylacetonitrile


Catalog No:   FT-0614701

CAS No:   39101-54-7

  • Molecular Formula:  145.2
  • Formula Weight: C10H11N
  • Inchl Key: LMUKNQSVBFEUKR-UHFFFAOYSA-N
  • Inchl: InChI=1S/C10H11N/c1-8-5-9(2)7-10(6-8)3-4-11/h5-7H,3H2,1-2H3

Assay Pack Price Stock Action
98% 1g N/A N/A
98% 5g N/A N/A
98% Bulk Quantity N/A N/A
Melting_Point: 41-44°C
CAS: 39101-54-7
MF: C10H11N
Flash_Point: 170°C/20mm
Product_Name: 3,5-Dimethylphenylacetonitrile
Density: 0.979 g/cm3
FW: 145.20100
Bolling_Point: 170°C 20mm
Refractive_Index: 1.524
Flash_Point: 170°C/20mm
LogP: 2.36948
Bolling_Point: 170°C 20mm
FW: 145.20100
PSA: 23.79000
Computational_Chemistry: ['1. XlogP :23 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :1 ', '4. Rotatable Bond Count :1 ', '5. Isotope Atom Count :N/A ', '6. TPSA 238 ', '7. Heavy Atom Count :11 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :155 ', '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: 41-44°C
MF: C10H11N
Exact_Mass: 145.08900
Density: 0.979 g/cm3
More_Info: ['1 . Appearance Solid ', '2 . Density(g/mL,20 ºC)Unknow ', '3 . Relative vapor density(g/mL,Atmosphere =1) Unknow ', '4 . Melting point(ºC)40 ', '5 . Boiling point(ºC)Unknow ', '6 . Boiling point(ºC, 22mm hg)170 ', '7 . Refractive indexUnknow ', '8 . Flash point(ºC)170°C/20mm ', '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']
Hazard_Class: 6.1
Risk_Statements(EU): R20/21/22
RIDADR: 3439
Safety_Statements: S36/37
HS_Code: 2926909090
Packing_Group: III

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