5-NITROTHIOPHENE-2-CARBONITRILE


Catalog No:   FT-0620723

CAS No:   16689-02-4

  • Chemical Name:  5-NITROTHIOPHENE-2-CARBONITRILE
  • Molecular Formula:  C5H2N2O2S
  • Molecular Weight:  154.15
  • InChI Key:  FLYONFCGDKAMIH-UHFFFAOYSA-N
  • InChI:  InChI=1S/C5H2N2O2S/c6-3-4-1-2-5(10-4)7(8)9/h1-2H

Product pricing and availability information
Assay Pack Size Price Stock Action
98% 1g N/A N/A
98% 5g N/A N/A
98% Bulk Quantity N/A N/A
Symbol: Danger
FW: 154.147
Density: 1.5±0.1 g/cm3
CAS: 16689-02-4
Bolling_Point: 273.9±25.0 °C at 760 mmHg
Product_Name: 5-Nitrothiophene-2-carbonitrile
Melting_Point: 42-46ºC
Flash_Point: 119.4±23.2 °C
MF: C5H2N2O2S
Molecular_Structure: ['1 . Molar refractive index 3549 ', '2 . Molar volume (m3/mol)1021 ', '3 . Parachor (902K)2949 ', '4 . Surface tension 694 ', '5 . Polarizability 1407']
Flash_Point: 119.4±23.2 °C
Refractive_Index: 1.611
FW: 154.147
Density: 1.5±0.1 g/cm3
Bolling_Point: 273.9±25.0 °C at 760 mmHg
Computational_Chemistry: ['1. XlogP :18 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :4 ', '4. Rotatable Bond Count :0 ', '5. Isotope Atom Count :N/A ', '6. TPSA 978 ', '7. Heavy Atom Count :10 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :192 ', '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: 0.81
Melting_Point: 42-46ºC
PSA: 97.85000
MF: C5H2N2O2S
More_Info: ['1. Appearance Unknow ', '2. Density(g/mL,25/4℃)Unknow ', '3. Relative vapor density(g/mL,Atmosphere =1)Unknow ', '4. Melting point(ºC)42-46°C5. Boiling point(ºC,Atmospheric pressure)Unknow ', '6. Boiling point(ºC,52kPa)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']
Vapor_Pressure: 0.0±0.6 mmHg at 25°C
Exact_Mass: 153.983704
Hazard_Codes: Xn: Harmful;
Symbol: Danger
Packing_Group: III
Hazard_Class: 6.1
Warning_Statement: P261-P280-P301 + P310-P305 + P351 + P338
HS_Code: 2934999090
Personal_Protective_Equipment: dust mask type N95 (US);Eyeshields;Faceshields;Gloves
Risk_Statements(EU): R20/21/22
Safety_Statements: S22-S36/37
RIDADR: UN 3439 6.1/PG 3

Related Products