Name: Name:1,1,1-Trifluoro-3-(pyrazin-2-yl)propan-2-one
Brand: AABLOCKS
SKU: AA00HDNZ
Rating: 90 (10 reviews)

Technical Information

Catalog Number: AA00HDNZ

Chemical Name: 1,1,1-Trifluoro-3-(pyrazin-2-yl)propan-2-one

CAS Number: 116655-36-8

Molecular Formula: C7H5F3N2O

Molecular Weight: 190.1226

MDL Number: MFCD28369603

SMILES: O=C(C(F)(F)F)Cc1nccnc1

Properties

Complexity: 193

Covalently-Bonded Unit Count: 1

Defined Atom Stereocenter Count: 0

Defined Bond Stereocenter Count: 0

Formal Charge: 0

Heavy Atom Count: 13

Hydrogen Bond Acceptor Count: 6

Hydrogen Bond Donor Count: 0

Isotope Atom Count: 0

Rotatable Bond Count: 2

Undefined Atom Stereocenter Count: 0

Undefined Bond Stereocenter Count: 0

XLogP3: 0.6

Downstream Synthesis Route

116655-36-8

116655-41-5

[1]Mainagashev,I.Ya.;Lapachev,V.V.;Fedotov,M.A.;Mamaev,V.P.[ChemistryofHeterocyclicCompounds,1987,vol.23,#12,p.1339-1342][KhimiyaGeterotsiklicheskikhSoedinenii,1987,#12,p.1663-1667]

116655-41-5

116655-36-8

[1]Mainagashev,I.Ya.;Lapachev,V.V.;Fedotov,M.A.;Mamaev,V.P.[ChemistryofHeterocyclicCompounds,1987,vol.23,#12,p.1339-1342][KhimiyaGeterotsiklicheskikhSoedinenii,1987,#12,p.1663-1667]

116655-36-8 | 1,1,1-Trifluoro-3-(pyrazin-2-yl)propan-2-one