5-BROMO-6-HYDROXYNICOTINIC ACID (CAS: 41668-13-7) - Chemical Structure and Molecular Formula
5-BROMO-6-HYDROXYNICOTINIC ACID (CAS: 41668-13-7) - Chemical Structure Thumbnail

5-BROMO-6-HYDROXYNICOTINIC ACID

Catalog No:   FT-0650465

CAS No:   41668-13-7

  • Chemical Name:  5-BROMO-6-HYDROXYNICOTINIC ACID
  • Molecular Formula:  C6H4BrNO3
  • Molecular Weight:  218
  • InChI Key:  PQDLYKZCJBGXPQ-UHFFFAOYSA-N
  • InChI:  InChI=1S/C6H4BrNO3/c7-4-1-3(6(10)11)2-8-5(4)9/h1-2H,(H,8,9)(H,10,11)
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
Product_Name: 5-Bromo-6-hydroxynicotinic acid
Flash_Point: 218.7±28.7 °C
Melting_Point: >300ºC
FW: 218.005
Density: 2.0±0.1 g/cm3
CAS: 41668-13-7
Bolling_Point: 437.9±45.0 °C at 760 mmHg
MF: C6H4BrNO3
Molecular_Structure: ['1 . Molar refractive index 3963 ', '2 . Molar volume 1081 ', '3 . Parachor （902K）3168 ', '4 . Surface tension 736 ', '5 . Polarizability 1571']
LogP: 0.32
Flash_Point: 218.7±28.7 °C
Refractive_Index: 1.666
FW: 218.005
Density: 2.0±0.1 g/cm3
Bolling_Point: 437.9±45.0 °C at 760 mmHg
Computational_Chemistry: ['1. XlogP :04 ', '2. Hydrogen Bond Donor Count :2 ', '3. Hydrogen Bond Acceptor Count :3 ', '4. Rotatable Bond Count :1 ', '5. Isotope Atom Count :4 ', '6. TPSA 664 ', '7. Heavy Atom Count :11 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :280 ', '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: >300ºC
PSA: 70.16000
MF: C6H4BrNO3
More_Info: ['1. Melting point（760 mmHg,ºC）>300']
Vapor_Pressure: 0.0±1.1 mmHg at 25°C
Exact_Mass: 216.937454
Hazard_Codes: Xi: Irritant;
HS_Code: 2933399090

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