1-(p-Toluenesulfonyl)-3-nitro-1,2,4-triazole


Catalog No:   FT-0641648

CAS No:   77451-51-5

  • Molecular Formula:  268.249
  • Formula Weight: C9H8N4O4S

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: 1-(p-Toluenesulfonyl)-3-nitro-1,2,4-triazole
Flash_Point: 269.8±28.2 °C
Melting_Point: 133-135 °C(lit.)
FW: 268.249
Density: 1.6±0.1 g/cm3
CAS: 77451-51-5
Bolling_Point: 522.4±43.0 °C at 760 mmHg
MF: C9H8N4O4S
Molecular_Structure: ['五分子性质数据 ', '1 . Molar refractive index 6421 ', '2 . Molar volume (m3/mol)1655 ', '3 . Parachor (902K)4849 ', '4 . Surface tension 736 ', '5 . Dielectric constant N/A ', '6 偶极距(10 -24cm 3)N/A ', '7 . Polarizability 2545']
LogP: 1.16
Flash_Point: 269.8±28.2 °C
Refractive_Index: 1.703
FW: 268.249
Density: 1.6±0.1 g/cm3
Bolling_Point: 522.4±43.0 °C at 760 mmHg
Computational_Chemistry: ['1. XlogP :18 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :6 ', '4. Rotatable Bond Count :2 ', '5. Isotope Atom Count :N/A ', '6. TPSA 119 ', '7. Heavy Atom Count :18 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :407 ', '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: 133-135 °C(lit.)
PSA: 119.05000
MF: C9H8N4O4S
Vapor_Pressure: 0.0±1.4 mmHg at 25°C
Exact_Mass: 268.026611
Hazard_Codes: Xi: Irritant;
Risk_Statements(EU): 36/37/38
HS_Code: 2933990090
WGK_Germany: 3
Safety_Statements: S26-S37/39

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