4-(4-tert-Butylphenyl)-4-oxo-2-{[5-(trifluoromethyl)pyridin-2-yl]sulfanyl}butanoic acid

Catalog No. :
ACLJET655
CAS No. :
279691-64-4
Molecular Formula :
C20H20F3NO3S
Molecular Weight :
411.45

IUPAC Name:4-(4-(tert-butyl)phenyl)-4-oxo-2-((5-(trifluoromethyl)pyridin-2-yl)thio)butanoic acid

4-(4-tert-Butylphenyl)-4-oxo-2-{[5-(trifluoromethyl)pyridin-2-yl]sulfanyl}butanoic acid structure diagram
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Product Information

Product Name4-(4-tert-Butylphenyl)-4-oxo-2-{[5-(trifluoromethyl)pyridin-2-yl]sulfanyl}butanoic acid
IUPAC Name4-(4-(tert-butyl)phenyl)-4-oxo-2-((5-(trifluoromethyl)pyridin-2-yl)thio)butanoic acid
MDL No.MFCD00179547
Molecular FormulaC20H20F3NO3S
Molecular Weight411.45
SMILESO=C(O)C(SC1=NC=C(C(F)(F)F)C=C1)CC(C2=CC=C(C(C)(C)C)C=C2)=O
InChI KeyRVXPGJOMAFOWJB-UHFFFAOYSA-N
Synonym4-[4-(TERT-BUTYL)PHENYL]-4-OXO-2-([5-(TRIFLUOROMETHYL)-2-PYRIDINYL]SULFANYL)BUTANOIC ACID;4-(4-tert-butylphenyl)-4-oxo-2-{[5-(trifluoromethyl)pyridin-2-yl]sulfanyl}butanoic acid;Benzenebutanoic acid, 4-(1,1-dimethylethyl)-γ-oxo-α-[[5-(trifluoromethyl)-2-pyridinyl]thio]-
CAS No.279691-64-4

Safety Data

Pictogram
Harmful or irritant
Signal Word
Achtung
Hazard Statement(s)
H302-H315-H319-H335
Precautionary Statement(s)
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P330-P362-P403+P233-P501

Synthetic Route by SureRoute

1. ACLJET655 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Then
  3. ACLJET655 route product structure diagram
    ACLJET655279691-64-4
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2. ACLJET655 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Then
  3. ACLJET655 route product structure diagram
    ACLJET655279691-64-4
Inquiry

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