2-CHLOROBENZOYLACETONITRILE


Catalog No:   FT-0604211

CAS No:   40018-25-5

  • Molecular Formula:  179.6
  • Formula Weight: C9H6ClNO
  • Inchl Key: SBSWHTFHLWSSQS-UHFFFAOYSA-N
  • Inchl: InChI=1S/C9H6ClNO/c10-8-4-2-1-3-7(8)9(12)5-6-11/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
Bolling_Point: 302.2±22.0 °C at 760 mmHg
MF: C9H6ClNO
Density: 1.3±0.1 g/cm3
FW: 179.603
Product_Name: 3-(2-Chlorophenyl)-3-oxopropanenitrile
CAS: 40018-25-5
Flash_Point: 136.6±22.3 °C
Melting_Point: 55-59 °C
Bolling_Point: 302.2±22.0 °C at 760 mmHg
LogP: 1.39
More_Info: ['1 . Appearance 粉末 ', '2 . Density(g/mL,20ºC)Unknow ', '3 . Relative vapor density(g/mL,Atmosphere =1) Unknow ', '4 . Melting point(ºC)56-57 ', '5 . Boiling point(ºC)Unknow ', '6 . Boiling point(ºC,13mm hg)Unknow ', '7 . Refractive indexUnknow ', '8 . Flash point(ºC)Unknow ', '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']
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 :2 ', '6. TPSA 409 ', '7. Heavy Atom Count :12 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :218 ', '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: 55-59 °C
Vapor_Pressure: 0.0±0.6 mmHg at 25°C
Exact_Mass: 179.013794
MF: C9H6ClNO
Density: 1.3±0.1 g/cm3
Refractive_Index: 1.553
PSA: 40.86000
Flash_Point: 136.6±22.3 °C
FW: 179.603
Safety_Statements: S36/37/39-S26-S22
Packing_Group: III
RIDADR: 3276
Hazard_Codes: Xn:Harmful;
HS_Code: 2926909090
Risk_Statements(EU): R20/21/22;R36/37/38

Related Products