1,3-dichloro-2-isothiocyanatobenzene


Catalog No:   FT-0764194

CAS No:   6590-95-0

  • Chemical Name:  1,3-dichloro-2-isothiocyanatobenzene
  • Molecular Formula:  C7H3Cl2NS
  • Molecular Weight:  204.08
  • InChI Key:  SUCGVQHNGIQXGD-UHFFFAOYSA-N
  • InChI:  InChI=1S/C7H3Cl2NS/c8-5-2-1-3-6(9)7(5)10-4-11/h1-3H

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: GHS05
CAS: 6590-95-0
Flash_Point: >230 °F
Product_Name: 2,6-Dichlorophenyl Isothiocyanate
Bolling_Point: 122-124°C 8mm
FW: 204.07600
Melting_Point: 38-42 °C(lit.)
MF: C7H3Cl2NS
Density: 1.37g/cm3
FW: 204.07600
Melting_Point: 38-42 °C(lit.)
Refractive_Index: 1.614
MF: C7H3Cl2NS
Exact_Mass: 202.93600
LogP: 3.72770
Bolling_Point: 122-124°C 8mm
Density: 1.37g/cm3
PSA: 44.45000
Computational_Chemistry: ['1. XlogP :46 ', '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 444 ', '7. Heavy Atom Count :11 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :169 ', '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']
Flash_Point: >230 °F
Symbol: GHS05
RIDADR: UN 3261 8/PG 3
HS_Code: 2930909090
Packing_Group: II
Hazard_Class: 6.1
Risk_Statements(EU): R20/21/22;R34
WGK_Germany: 3
Personal_Protective_Equipment: Eyeshields;Faceshields;full-face particle respirator type N100 (US);Gloves;respirator cartridge type N100 (US);type P1 (EN143) respirator filter;type P3 (EN 143) respirator cartridges
Hazard_Codes: C
Warning_Statement: P280-P305 + P351 + P338-P310
Safety_Statements: H314

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