4-METHYLBENZOYLACETONITRILE


Catalog No:   FT-0604218

CAS No:   7391-28-8

  • Molecular Formula:  159.18
  • Formula Weight: C10H9NO
  • Inchl Key: AIECDYDQPCANJK-UHFFFAOYSA-N
  • Inchl: InChI=1S/C10H9NO/c1-8-2-4-9(5-3-8)10(12)6-7-11/h2-5H,6H2,1H3

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: 105-108 °C(lit.)
CAS: 7391-28-8
MF: C10H9NO
Flash_Point: 146.2±23.2 °C
Product_Name: 3-(4-Methylphenyl)-3-oxopropanenitrile
Density: 1.1±0.1 g/cm3
FW: 159.185
Bolling_Point: 318.2±25.0 °C at 760 mmHg
Refractive_Index: 1.533
Vapor_Pressure: 0.0±0.7 mmHg at 25°C
Flash_Point: 146.2±23.2 °C
LogP: 1.43
Bolling_Point: 318.2±25.0 °C at 760 mmHg
PSA: 40.86000
Molecular_Structure: ['1 . Molar refractive index 4565 ', '2 . Molar volume (m3/mol)1471 ', '3 . Parachor (902K)3781 ', '4 . Surface tension 436 ', '5 . Polarizability (10 -24cm 3)1809']
Computational_Chemistry: ['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :2 ', '4. Rotatable Bond Count :2 ', '5. Isotope Atom Count :7 ', '6. TPSA 409 ', '7. Heavy Atom Count :12 ', '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: 105-108 °C(lit.)
MF: C10H9NO
Exact_Mass: 159.068420
FW: 159.185
Density: 1.1±0.1 g/cm3
More_Info: ['1 . Appearance 粉末 ', '2 . Density(g/mL,25/4℃) 无可用 ', '3 . Relative vapor density(g/mL,Atmosphere =1)无可用 ', '4 . Melting point(ºC)105-108 ', '5 . Boiling point(ºC,Atmospheric pressure)无可用 ', '6 . Boiling point(ºC,52kPa) 无可用 ', '7 . Refractive index 无可用 ', '8 . Flash point(ºC)无可用 ', '9 . Specific rotation(º)无可用 ', '10 . Spontaneous ignition point or ignition temperature(ºC)无可用 ', '11 . Vapor pressure(kPa,25ºC)无可用 ', '12 . Saturated vapor pressure(kPa,60ºC)无可用 ', '13 . Combustion heat(KJ/mol)无可用 ', '14 . Critical temperature(ºC)无可用 ', '15 . Critical pressure(KPa)无可用 ', '16 . Oil-water(Octanol /Water )Logarithmic Value of Distribution Coefficient 无可用 ', '17 . Upper limit of explosion(%,V/V)无可用 ', '18 . Lower limit of explosion(%,V/V) 无可用 ', '19 . Solubility 无可用']
Hazard_Class: 6.1
Risk_Statements(EU): R20/21/22
WGK_Germany: 3
Personal_Protective_Equipment: Eyeshields;Gloves;type N95 (US);type P1 (EN143) respirator filter
RIDADR: 3276
Hazard_Codes: Xn:Harmful;
HS_Code: 2926909090
Safety_Statements: S26-S36/37/39
Packing_Group: III

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