Methyl 4-ethynyl-3-(2,2,2-trifluoroethoxy)benzoate

Catalog No. :
ACKIDM335
CAS No. :
2819691-48-8
Molecular Formula :
C12H9F3O3
Molecular Weight :
258.20

IUPAC Name:methyl 4-ethynyl-3-(2,2,2-trifluoroethoxy)benzoate

Methyl 4-ethynyl-3-(2,2,2-trifluoroethoxy)benzoate structure diagram
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Product Information

Product NameMethyl 4-ethynyl-3-(2,2,2-trifluoroethoxy)benzoate
IUPAC Namemethyl 4-ethynyl-3-(2,2,2-trifluoroethoxy)benzoate
MDL No.MFCD33023730
Molecular FormulaC12H9F3O3
Molecular Weight258.20
SMILESO=C(OC)C1=CC=C(C#C)C(OCC(F)(F)F)=C1
InChI KeyXZNKRJZKGNRLQY-UHFFFAOYSA-N
SynonymBenzoic acid, 4-ethynyl-3-(2,2,2-trifluoroethoxy)-, methyl ester
CAS No.2819691-48-8

Synthetic Route by SureRoute

1. ACKIDM335 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Then
  3. ACKIDM335 route product structure diagram
    ACKIDM3352819691-48-8
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2. ACKIDM335 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Plus
  3. reactant_2 route compound structure diagram
    --
  4. Then
  5. ACKIDM335 route product structure diagram
    ACKIDM3352819691-48-8
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