Products 1803026-54-1

CAS 1803026-54-1 appears in our catalog under these names: Sitagliptin Impurity 51, (Z)-1-(3-(Trifluoromethyl)-5,6-dihydro-[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl)-4-(2,4,5-trifluorophenyl)but-2-en-1-one, 95%, (2Z)-1-(5,6-Dihydro-3-(trifluoromethyl)-1,2,4-triazolo(4,3-a)pyrazin-7(8H)-yl)-4-(2,4,5-trifluorophenyl)-2-buten-1-one, (2Z)-1-(5,6-Dihydro-3-(trifluoromethyl)-1,2,4-triazolo(4,3-α)pyrazin-7(8H)-yl)-4-(2,4,5-trifluorophenyl)-2-buten-1-one. Offered by: Chemat Brand, TRC, Biosynth. Available pack sizes: on request, 100mg, 50mg.

Sitagliptin Impurity 51
Chemat Brand
  • size: on request
  • Variants: 1
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(Z)-1-(3-(Trifluoromethyl)-5,6-dihydro-[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl)-4-(2,4,5-trifluorophenyl)but-2-en-1-one, 95%
Chemat Brand
  • size: on request
  • Variants: 1
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(2Z)-1-(5,6-Dihydro-3-(trifluoromethyl)-1,2,4-triazolo(4,3-a)pyrazin-7(8H)-yl)-4-(2,4,5-trifluorophenyl)-2-buten-1-one
TRC
  • size: 100mg
  • Variants: 1
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(2Z)-1-(5,6-Dihydro-3-(trifluoromethyl)-1,2,4-triazolo(4,3-α)pyrazin-7(8H)-yl)-4-(2,4,5-trifluorophenyl)-2-buten-1-one
Biosynth
  • size: 50mg
  • Variants: 1
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Structural formula: {0} (CAS {1})

(Z)-1-[3-(trifluoromethyl)-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl]-4-(2,4,5-trifluorophenyl)but-2-en-1-one (CAS 1803026-54-1) is a chemical compound with the molecular formula C16H12F6N4O and a molecular weight of 390.28 g/mol. IUPAC name: (Z)-1-[3-(trifluoromethyl)-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl]-4-(2,4,5-trifluorophenyl)but-2-en-1-one. InChIKey: QSSHJJFVCWMIKH-IWQZZHSRSA-N.

Identity
Molecular formulaC16H12F6N4O
Molecular weight390.28 g/mol
IUPAC name(Z)-1-[3-(trifluoromethyl)-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl]-4-(2,4,5-trifluorophenyl)but-2-en-1-one
InChIKeyQSSHJJFVCWMIKH-IWQZZHSRSA-N
SMILESC1CN2C(=NN=C2C(F)(F)F)CN1C(=O)/C=C\CC3=CC(=C(C=C3F)F)F

Computed by PubChem (NCBI)

Related forms of this compound
(E)-1-[3-(trifluoromethyl)-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl]-4-(2,4,5-trifluorophenyl)but-2-en-1-one C16H12F6N4O
1-[3-(trifluoromethyl)-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl]-4-(2,4,5-trifluorophenyl)but-2-en-1-one C16H12F6N4O
Isomers (same molecular formula)
1-[3-(trifluoromethyl)-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl]-4-(2,4,5-trifluorophenyl)but-3-en-1-one C16H12F6N4O
(E)-1-[3-(trifluoromethyl)-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl]-4-(2,4,5-trifluorophenyl)but-3-en-1-one C16H12F6N4O