1,4-Dideoxy-1,4-dihydro-1,4-dioxo-rifamycin


Catalog No:   FT-0654816

CAS No:   13553-79-2

  • Chemical Name:  1,4-Dideoxy-1,4-dihydro-1,4-dioxo-rifamycin
  • Molecular Formula:  C37H45NO12
  • Molecular Weight:  695.8
  • InChI Key:  BTVYFIMKUHNOBZ-ODRIEIDWSA-N
  • InChI:  InChI=1S/C37H45NO12/c1-16-11-10-12-17(2)36(46)38-23-15-24(40)26-27(32(23)44)31(43)21(6)34-28(26)35(45)37(8,50-34)48-14-13-25(47-9)18(3)33(49-22(7)39)20(5)30(42)19(4)29(16)41/h10-16,18-20,25,29-30,33,41-43H,1-9H3,(H,38,46)/b11-10+,14-13+,17-12-/t16-,18+,19+,20+,25-,29-,30+,33+,37-/m0/s1

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: RifamycinS
Flash_Point: 508.6±34.3 °C
Melting_Point: 179-181ºC (dec.)
FW: 695.753
Density: 1.3±0.1 g/cm3
CAS: 13553-79-2
Bolling_Point: 917.4±65.0 °C at 760 mmHg
MF: C37H45NO12
LogP: 2.87
Flash_Point: 508.6±34.3 °C
Refractive_Index: 1.605
FW: 695.753
Density: 1.3±0.1 g/cm3
Bolling_Point: 917.4±65.0 °C at 760 mmHg
Computational_Chemistry: ['1. XlogP :41 ', '2. Hydrogen Bond Donor Count :4 ', '3. Hydrogen Bond Acceptor Count :12 ', '4. Rotatable Bond Count :3 ', '5. Isotope Atom Count :339 ', '6. TPSA :195 ', '7. Heavy Atom Count :50 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :1480 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :9 ', '12. Undefined Atom Stereocenter Count :0 ', '13. Defined Bond Stereocenter Count :3 ', '14. Undefined Bond Stereocenter Count :0 ', '15. Covalently-Bonded Unit Count :1']
Melting_Point: 179-181ºC (dec.)
PSA: 194.99000
MF: C37H45NO12
Vapor_Pressure: 0.0±0.3 mmHg at 25°C
Exact_Mass: 695.294189
HS_Code: 2941903000

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