

3,4-DICHLOROBENZOYLACETONITRILE
Catalog No: FT-0604190
CAS No: 4640-68-0
- Molecular Formula: 214.04
- Formula Weight: C9H5Cl2NO
- Inchl Key: HUEULXLHYYYTTP-UHFFFAOYSA-N
- Inchl: InChI=1S/C9H5Cl2NO/c10-7-2-1-6(5-8(7)11)9(13)3-4-12/h1-2,5H,3H2
Assay | Pack | Price | Stock | Action |
---|---|---|---|---|
98% | 1g | N/A | N/A | |
98% | 5g | N/A | N/A | |
98% | Bulk Quantity | N/A | N/A |
Product_Name: | 3-(3,4-Dichlorophenyl)-3-oxopropanenitrile |
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Flash_Point: | 194.7±26.5 °C |
Melting_Point: | 114 °C |
FW: | 214.048 |
Density: | 1.4±0.1 g/cm3 |
CAS: | 4640-68-0 |
Bolling_Point: | 398.4±37.0 °C at 760 mmHg |
MF: | C9H5Cl2NO |
Molecular_Structure: | ['1 . Molar refractive index 5061 ', '2 . Molar volume (m3/mol)1547 ', '3 . Parachor (902K)4122 ', '4 . Surface tension 503 ', '5 . Polarizability (10 -24cm 3)2006'] |
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Flash_Point: | 194.7±26.5 °C |
Refractive_Index: | 1.568 |
FW: | 214.048 |
Density: | 1.4±0.1 g/cm3 |
Bolling_Point: | 398.4±37.0 °C at 760 mmHg |
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 :13 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :245 ', '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'] |
LogP: | 2.38 |
Melting_Point: | 114 °C |
PSA: | 40.86000 |
MF: | C9H5Cl2NO |
More_Info: | ['1 . Appearance Yellow Solid ', '2 . Density(g/mL,25/4℃)不确定 ', '3 . Relative vapor density(g/mL,Atmosphere =1)不确定 ', '4 . Melting point(ºC)114 ', '5 . Boiling point(ºC,Atmospheric pressure)不确定 ', '6 . Boiling point(ºC,720mmHg)不确定 ', '7 . Refractive index不确定 ', '8 . Flash point(ºF)不确定 ', '9 . Specific rotation(º,C=1, H2O)不确定 ', '10 . Spontaneous ignition point or ignition temperature(ºC)不确定 ', '11 . Vapor pressure(kPa,25ºC)不确定 ', '12 . Saturated vapor pressure(kPa,60ºC)不确定 ', '13 . Combustion heat(KJ/mol)不确定 ', '14 . Critical temperature(ºC)不确定 ', '15 . Critical pressure(KPa)不确定 ', '16 . Oil-water(Octanol /Water )Logarithmic Value of Distribution Coefficient 不确定 ', '17 . Upper limit of explosion(%,V/V)不确定 ', '18 . Lower limit of explosion(%,V/V)不确定 ', '19 . Solubility 不确定'] |
Vapor_Pressure: | 0.0±0.9 mmHg at 25°C |
Exact_Mass: | 212.974823 |
Hazard_Codes: | Xi |
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Risk_Statements(EU): | R36/37/38 |
HS_Code: | 2926909090 |
Safety_Statements: | S26-S36/37/39 |
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