Benzoyl isothiocyanate


Catalog No:   FT-0622740

CAS No:   532-55-8

  • Molecular Formula:  163.2
  • Formula Weight: C8H5NOS
  • Inchl Key: CPEKAXYCDKETEN-UHFFFAOYSA-N
  • Inchl: InChI=1S/C8H5NOS/c10-8(9-6-11)7-4-2-1-3-5-7/h1-5H

Assay Pack Price Stock Action
98% 1g N/A N/A
98% 5g N/A N/A
98% Bulk Quantity N/A N/A
FW: 163.196
CAS: 532-55-8
Flash_Point: 106.0±18.7 °C
MF: C8H5NOS
Symbol: Danger
Bolling_Point: 251.7±9.0 °C at 760 mmHg
Melting_Point: 128 °C
Product_Name: benzoylthiocarbimide
Density: 1.1±0.1 g/cm3
FW: 163.196
MF: C8H5NOS
Water_Solubility: almost insoluble
Refractive_Index: 1.586
Vapor_Pressure: 0.0±0.5 mmHg at 25°C
Bolling_Point: 251.7±9.0 °C at 760 mmHg
Exact_Mass: 163.009186
PSA: 61.52000
Computational_Chemistry: ['1. XlogP :32 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :2 ', '4. Rotatable Bond Count :1 ', '5. Isotope Atom Count :N/A ', '6. TPSA 615 ', '7. Heavy Atom Count :11 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :190 ', '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']
Molecular_Structure: ['1 . Molar refractive index 4809 ', '2 . Molar volume (m3/mol)1433 ', '3 . Parachor (902K)3626 ', '4 . Surface tension 409 ', '5 . Polarizability 1906']
LogP: 2.80
Melting_Point: 128 °C
Flash_Point: 106.0±18.7 °C
Density: 1.1±0.1 g/cm3
More_Info: ['1 . Appearance Yellow or 橙Yellow Liquid ', '2 . Density(g/ cm3,25/4℃)1197 ', '3 . Relative vapor density(g/cm3,Atmosphere =1)Unknow ', '4 . Melting point(ºC)-1 ', '5 . Boiling point(ºC,Atmospheric pressure)252 ', '6 . Boiling point(ºC,8kPa)Unknow ', '7 . Refractive index16382 ', '8 . Flash point(ºF)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,551ºC)Unknow ', '13 . Combustion heat(KJ/mol)489 ', '14 . Critical temperature(ºC)Unknow ', '15 . Critical pressure(KPa)Unknow ', '16 . Oil-water(Octanol /Water )Logarithmic Value of Distribution Coefficient 28 ', '17 . Upper limit of explosion(%,V/V)Unknow ', '18 . Lower limit of explosion(%,V/V)Unknow ', '19 . Solubility 难Soluble in Water ']
Supplementary_Hazard_Statement: Contact with acids liberates very toxic gas.
Personal_Protective_Equipment: Eyeshields;Faceshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter
HS_Code: 29309070
Symbol: Danger
Risk_Statements(EU): R25;R32;R36;R43
WGK_Germany: 3
Warning_Statement: P280-P301 + P310-P305 + P351 + P338
Packing_Group: III
Safety_Statements: H301-H317-H318
RIDADR: UN 2810 6.1/PG 3
Hazard_Codes: T:Toxic;
Hazard_Class: 6.1

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