3-METHYL-2(3H)-BENZOTHIAZOLONE


Catalog No:   FT-0616046

CAS No:   2786-62-1

  • Molecular Formula:  165.21
  • Formula Weight: C8H7NOS
  • Inchl Key: LSMMRJUHLKJNLR-UHFFFAOYSA-N
  • Inchl: InChI=1S/C8H7NOS/c1-9-6-4-2-3-5-7(6)11-8(9)10/h2-5H,1H3

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: 74-77ºC(lit.)
CAS: 2786-62-1
MF: C8H7NOS
Flash_Point: 131.8ºC
Product_Name: 3-methyl-2(3h)-benzothiazolone
Density: 1.315g/cm3
FW: 165.21200
Bolling_Point: 294.3ºC at 760mmHg
Refractive_Index: 1.672
Flash_Point: 131.8ºC
LogP: 1.60000
Bolling_Point: 294.3ºC at 760mmHg
PSA: 50.24000
Molecular_Structure: ['1 . Molar refractive index 4577 ', '2 . Molar volume (m3/mol)1255 ', '3 . Parachor (902K)3363 ', '4 . Surface tension 515 ', '5 . Dielectric constant (F/m)无可用 ', '6 偶极距(D)无可用 ', '7 . Polarizability (10 -24cm 3)1814']
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 456 ', '7. Heavy Atom Count :11 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :183 ', '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: 74-77ºC(lit.)
MF: C8H7NOS
Exact_Mass: 165.02500
FW: 165.21200
Density: 1.315g/cm3
More_Info: ['1 . Appearance Unknow ', '2 . Density(g/mLat 25°C)Unknow ', '3 . Relative vapor density(g/mL,Atmosphere =1)Unknow ', '4 . Melting point(ºC)74-77 ', '5 . Boiling point(ºC,Atmospheric pressure)Unknow ', '6 . Boiling point(ºC,2mmHg)Unknow ', '7 . Refractive index(n20/D)Unknow ', '8 . Flash point(ºC)Unknow ', '9 . Specific rotation(º)Unknow ', '10 . Spontaneous ignition point or ignition temperature(ºC)Unknow ', '11 . Vapor pressure(hPa,211ºC)Unknow ', '12 . Saturated vapor pressure(kPa,1144 ºC)Unknow ', '13 . Combustion heat(KJ/mol)Unknow ', '14 . Critical temperature(ºC)Unknow ', '15 . Critical pressure(MPa)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']
RIDADR: NONH for all modes of transport
HS_Code: 2934200090

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