1,3-Dicyanobenzene


Catalog No:   FT-0627453

CAS No:   626-17-5

  • Molecular Formula:  128.13
  • Formula Weight: C8H4N2
  • Inchl Key: LAQPNDIUHRHNCV-UHFFFAOYSA-N
  • Inchl: InChI=1S/C8H4N2/c9-5-7-2-1-3-8(4-7)6-10/h1-4H

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: 626-17-5
Flash_Point: 106.4±13.7 °C
Product_Name: Isophthalonitrile
Bolling_Point: 239.0±13.0 °C at 760 mmHg
FW: 128.131
Melting_Point: 163-165 °C(lit.)
MF: C8H4N2
Density: 1.2±0.1 g/cm3
Refractive_Index: 1.566
Vapor_Pressure: 0.0±0.5 mmHg at 25°C
Flash_Point: 106.4±13.7 °C
LogP: 0.82
Bolling_Point: 239.0±13.0 °C at 760 mmHg
Water_Solubility: 0.7 g/L (20 ºC)
PSA: 47.58000
Molecular_Structure: ['1 . Molar refractive index 3588 ', '2 . Molar volume 1100 ', '3 . Parachor (902K)3006 ', '4 . Surface tension 556 ', '5 . Polarizability 1422']
Computational_Chemistry: ['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :2 ', '4. Rotatable Bond Count :0 ', '5. Isotope Atom Count :N/A ', '6. TPSA 476 ', '7. Heavy Atom Count :10 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :180 ', '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: 163-165 °C(lit.)
MF: C8H4N2
Exact_Mass: 128.037445
FW: 128.131
Density: 1.2±0.1 g/cm3
More_Info: ['1 . Appearance 晶状体粉末。 ', '2 . Density(g/mL,25/4℃)0992 ', '3 . Relative vapor density(g/mL,Atmosphere =1)Unknow ', '4 . Melting point(ºC)163-165 ', '5 . Boiling point(ºC,Atmospheric pressure)288 ', '6 . Boiling point(ºC,52kPa)Unknow ', '7 . Refractive indexUnknow ', '8 . Flash point(ºC)288 ', '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 易Soluble in 热醇and 热醚,能Soluble in 热Water 氯仿醇醚四氯化碳,Insoluble in 石油醚。']
Symbol: GHS07
RIDADR: 2811
HS_Code: 29269020
Packing_Group: III
Hazard_Class: 6.1(b)
Risk_Statements(EU): R20/22
WGK_Germany: 1
Personal_Protective_Equipment: dust mask type N95 (US);Eyeshields;Faceshields;Gloves
RTECS: CZ1900000
Hazard_Codes: Xn:Harmful;
Safety_Statements: H302 + H332

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