5-Chloro-6-(1-fluoroethyl)-4(1H)-pyrimidinone (CAS: 227184-12-5) - Chemical Structure and Molecular Formula
5-Chloro-6-(1-fluoroethyl)-4(1H)-pyrimidinone (CAS: 227184-12-5) - Chemical Structure Thumbnail

5-Chloro-6-(1-fluoroethyl)-4(1H)-pyrimidinone

Catalog No:   FT-0692702

CAS No:   227184-12-5

  • Chemical Name:  5-Chloro-6-(1-fluoroethyl)-4(1H)-pyrimidinone
  • Molecular Formula:  C6H6ClFN2O
  • Molecular Weight:  176.57
  • InChI Key:  CDZLZKAVXLOHFN-UHFFFAOYSA-N
  • InChI:  InChI=1S/C6H6ClFN2O/c1-3(8)5-4(7)6(11)10-2-9-5/h2-3H,1H3,(H,9,10,11)
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-chloro-6-(1-fluoroethyl)-1H-pyrimidin-4-one
Flash_Point: N/A
Melting_Point: N/A
FW: 176.57600
Density: N/A
CAS: 227184-12-5
Bolling_Point: N/A
MF: C6H6ClFN2O
Computational_Chemistry: ['1. XlogP :07 ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :2 ', '4. Rotatable Bond Count :1 ', '5. Isotope Atom Count :3 ', '6. TPSA 415 ', '7. Heavy Atom Count :11 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :249 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :0 ', '12. Undefined Atom Stereocenter Count :1 ', '13. Defined Bond Stereocenter Count :0 ', '14. Undefined Bond Stereocenter Count :0 ', '15. Covalently-Bonded Unit Count :1']
LogP: 1.86610
FW: 176.57600
PSA: 46.01000
MF: C6H6ClFN2O
Exact_Mass: 176.01500

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