Butyl 4-isothiocyanatobenzoate

Catalog No. :
ACVVCH029
CAS No. :
698992-36-8
Molecular Formula :
C12H13NO2S
Molecular Weight :
235.31

IUPAC Name:butyl 4-isothiocyanatobenzoate

Butyl 4-isothiocyanatobenzoate structure diagram
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Product Information

Product NameButyl 4-isothiocyanatobenzoate
IUPAC Namebutyl 4-isothiocyanatobenzoate
Molecular FormulaC12H13NO2S
Molecular Weight235.31
SMILESO=C(OCCCC)C1=CC=C(N=C=S)C=C1
InChI KeyCKWAGJXYHKPLKH-UHFFFAOYSA-N
Synonymbutyl 4-isothiocyanatobenzoate;Benzoic acid, 4-isothiocyanato-, butyl ester
CAS No.698992-36-8

Safety Data

Pictogram
ToxicHealth hazard
Signal Word
Gefahr
Hazard Statement(s)
H301-H315-H319-H334-H335
Precautionary Statement(s)
P261-P264-P270-P271-P280-P284-P301+P310+P330-P302+P352-P304+P340+P312-P305+P351+P338-P332+P313-P337+P313-P342+P311-P362+P364-P403+P233-P405-P501

Synthetic Route by SureRoute

1. ACVVCH029 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. ACVBFM634 route compound structure diagram
    ACVBFM63494-25-7 In Stock
  2. Plus
  3. reactant_2 route compound structure diagram
    --
  4. Then
  5. ACVVCH029 route product structure diagram
    ACVVCH029698992-36-8
Inquiry

2. ACVVCH029 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. ACVBFM634 route compound structure diagram
    ACVBFM63494-25-7 In Stock
  2. Plus
  3. reactant_2 route compound structure diagram
    --
  4. Then
  5. ACVVCH029 route product structure diagram
    ACVVCH029698992-36-8
Inquiry

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