Ethyl 2-isothiocyanato-3-phenylpropanoate

Catalog No. :
ACJPLN603
CAS No. :
62246-53-1
Molecular Formula :
C12H13NO2S
Molecular Weight :
235.31

IUPAC Name:ethyl 2-isothiocyanato-3-phenylpropanoate

Ethyl 2-isothiocyanato-3-phenylpropanoate structure diagram
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Product Information

Product NameEthyl 2-isothiocyanato-3-phenylpropanoate
IUPAC Nameethyl 2-isothiocyanato-3-phenylpropanoate
Molecular FormulaC12H13NO2S
Molecular Weight235.31
SMILESO=C(OCC)C(N=C=S)CC1=CC=CC=C1
InChI KeyYQTZICAZVVTABT-UHFFFAOYSA-N
SynonymEthyl 2-isothiocyanato-3-phenylpropanoate;Benzenepropanoic acid, α-isothiocyanato-, ethyl ester
CAS No.62246-53-1

Synthetic Route by SureRoute

1. ACJPLN603 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. ACJPLN603 route product structure diagram
    ACJPLN60362246-53-1
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2. ACJPLN603 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. ACJPLN603 route product structure diagram
    ACJPLN60362246-53-1
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