Methyl 2-oxo-2-(5-oxo-8-(trifluoromethyl)-2,3,4,5-tetrahydrobenzo[b]thiepin-4-yl)acetate

Catalog No. :
ACIOGQ675
CAS No. :
2055841-88-6
Molecular Formula :
C14H11F3O4S
Molecular Weight :
332.30

IUPAC Name:methyl 2-oxo-2-(5-oxo-8-(trifluoromethyl)-2,3,4,5-tetrahydrobenzo[b]thiepin-4-yl)acetate

Methyl 2-oxo-2-(5-oxo-8-(trifluoromethyl)-2,3,4,5-tetrahydrobenzo[b]thiepin-4-yl)acetate structure diagram
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Product Information

Product NameMethyl 2-oxo-2-(5-oxo-8-(trifluoromethyl)-2,3,4,5-tetrahydrobenzo[b]thiepin-4-yl)acetate
IUPAC Namemethyl 2-oxo-2-(5-oxo-8-(trifluoromethyl)-2,3,4,5-tetrahydrobenzo[b]thiepin-4-yl)acetate
MDL No.MFCD30530980
Molecular FormulaC14H11F3O4S
Molecular Weight332.30
SMILESO=C(OC)C(C1C(C2=CC=C(C(F)(F)F)C=C2SCC1)=O)=O
InChI KeyHAMXUUUTNCBICZ-UHFFFAOYSA-N
Synonym1-Benzothiepin-4-acetic acid, 2,3,4,5-tetrahydro-α,5-dioxo-8-(trifluoromethyl)-, methyl ester
CAS No.2055841-88-6

Safety Data

Pictogram
Harmful or irritant
Signal Word
Achtung
Hazard Statement(s)
H302-H315-H319-H335
Precautionary Statement(s)
P261-P280-P301+P312-P302+P352-P305+P351+P338

Synthetic Route by SureRoute

1. ACIOGQ675 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
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  5. ACIOGQ675 route product structure diagram
    ACIOGQ6752055841-88-6
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2. ACIOGQ675 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Plus
  3. reactant_2 route compound structure diagram
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  4. Then
  5. ACIOGQ675 route product structure diagram
    ACIOGQ6752055841-88-6
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