1,3-DIPROPYL-8-PHENYLXANTHINE


Catalog No:   FT-0642015

CAS No:   85872-53-3

  • Chemical Name:  1,3-DIPROPYL-8-PHENYLXANTHINE
  • Molecular Formula:  C17H20N4O2
  • Molecular Weight:  312.37
  • InChI Key:  CLIGSMOZKDCDRZ-UHFFFAOYSA-N
  • InChI:  InChI=1S/C17H20N4O2/c1-3-10-20-15-13(16(22)21(11-4-2)17(20)23)18-14(19-15)12-8-6-5-7-9-12/h5-9H,3-4,10-11H2,1-2H3,(H,18,19)

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
Melting_Point: N/A
CAS: 85872-53-3
MF: C17H20N4O2
Flash_Point: 279.8ºC
Product_Name: 1,3-Dipropyl-8-phenylxanthine
Density: 1.218g/cm3
FW: 312.36600
Bolling_Point: 539.1ºC at 760 mmHg
Refractive_Index: 1.587
MF: C17H20N4O2
Flash_Point: 279.8ºC
LogP: 2.37330
FW: 312.36600
Density: 1.218g/cm3
PSA: 72.68000
Bolling_Point: 539.1ºC at 760 mmHg
Computational_Chemistry: ['1 . XlogP 4 ', '2 . Hydrogen Bond Donor Count 1 ', '3 . Hydrogen Bond Acceptor Count 3 ', '4 . Rotatable Bond Count 5 ', '5 . Isotope Atom Count 3 ', '6 . TPSA 693 ', '7 . Heavy Atom Count 23 ', '8 . Topological Polar Surface Area 0 ', '9 . Complexity 450 ', '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']
Exact_Mass: 312.15900
HS_Code: 2933990090

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