1-Ethoxy-4,4,4-trifluoro-3-(4-methoxypyridin-1-ium-1-yl)-1-oxobut-2-ene-2-thiolate

Catalog No. :
ACBTDL358
CAS No. :
2408826-38-8
Molecular Formula :
C12H12F3NO3S
Molecular Weight :
307.29

IUPAC Name:(Z)-1-ethoxy-4,4,4-trifluoro-3-(4-methoxypyridin-1-ium-1-yl)-1-oxobut-2-ene-2-thiolate

1-Ethoxy-4,4,4-trifluoro-3-(4-methoxypyridin-1-ium-1-yl)-1-oxobut-2-ene-2-thiolate structure diagram
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Product Information

Product Name1-Ethoxy-4,4,4-trifluoro-3-(4-methoxypyridin-1-ium-1-yl)-1-oxobut-2-ene-2-thiolate
IUPAC Name(Z)-1-ethoxy-4,4,4-trifluoro-3-(4-methoxypyridin-1-ium-1-yl)-1-oxobut-2-ene-2-thiolate
Molecular FormulaC12H12F3NO3S
Molecular Weight307.29
SMILES[S-]/C(C(OCC)=O)=C([N+]1=CC=C(OC)C=C1)/C(F)(F)F
InChI KeyBTKZKVCBIUDRLZ-KTKRTIGZSA-N
SynonymPyridinium, 1-[3-ethoxy-2-mercapto-3-oxo-1-(trifluoromethyl)-1-propen-1-yl]-4-methoxy-, inner salt
CAS No.2408826-38-8

Synthetic Route by SureRoute

1. ACBTDL358 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
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  2. Plus
  3. reactant_2 route compound structure diagram
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  4. Then
  5. ACBTDL358 route product structure diagram
    ACBTDL3582408826-38-8
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2. ACBTDL358 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Plus
  3. ACPJVD652 route compound structure diagram
    ACPJVD652207511-18-0 In Stock
  4. Then
  5. ACBTDL358 route product structure diagram
    ACBTDL3582408826-38-8
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