1H-1,2,4-Triazole-3-thiol


Catalog No:   FT-0615942

CAS No:   3179-31-5

  • Molecular Formula:  101.13
  • Formula Weight: C2H3N3S
  • Inchl Key: AFBBKYQYNPNMAT-UHFFFAOYSA-N
  • Inchl: InChI=1S/C2H3N3S/c6-2-3-1-4-5-2/h1H,(H2,3,4,5,6)

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: 221-224 °C(lit.)
CAS: 3179-31-5
MF: C2H3N3S
Flash_Point: 120.6±22.6 °C
Product_Name: 1H-1,2,4-Triazole-3-thiol
Density: 1.5±0.1 g/cm3
FW: 101.130
Bolling_Point: 275.8±23.0 °C at 760 mmHg
Refractive_Index: 1.673
Vapor_Pressure: 0.0±0.6 mmHg at 25°C
Flash_Point: 120.6±22.6 °C
LogP: 0.18
Bolling_Point: 275.8±23.0 °C at 760 mmHg
PSA: 80.37000
Molecular_Structure: ['1 . Molar refractive index 2504 ', '2 . Molar volume (m3/mol)668 ', '3 . Parachor (902K)2036 ', '4 . Surface tension 863 ', '5 . Polarizability 992']
Computational_Chemistry: ['1. XlogP :-02 ', '2. Hydrogen Bond Donor Count :2 ', '3. Hydrogen Bond Acceptor Count :1 ', '4. Rotatable Bond Count :0 ', '5. Isotope Atom Count :5 ', '6. TPSA 685 ', '7. Heavy Atom Count :6 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :97 ', '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: 221-224 °C(lit.)
MF: C2H3N3S
Exact_Mass: 101.004768
FW: 101.130
Density: 1.5±0.1 g/cm3
More_Info: ['1 . Appearance White 晶体 ', '2 . Density(g/mL,25/4℃)无可用 ', '3 . Relative vapor density(g/mL,Atmosphere =1)无可用 ', '4 . Melting point(ºC)221-222 ', '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']
Risk_Statements(EU): R22;R36
WGK_Germany: 1
RTECS: XZ5267500
Hazard_Codes: Xi:Irritant;
HS_Code: 29339990
Safety_Statements: S26-S33-S39-S7/8

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