tert-Butyl 3-isothiocyanatobenzoate

Catalog No. :
ACPLYB897
CAS No. :
486415-53-6
Molecular Formula :
C12H13NO2S
Molecular Weight :
235.31

IUPAC Name:tert-butyl 3-isothiocyanatobenzoate

tert-Butyl 3-isothiocyanatobenzoate structure diagram
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Product Information

Product Nametert-Butyl 3-isothiocyanatobenzoate
IUPAC Nametert-butyl 3-isothiocyanatobenzoate
MDL No.MFCD03453225
Molecular FormulaC12H13NO2S
Molecular Weight235.31
SMILESO=C(OC(C)(C)C)C1=CC=CC(N=C=S)=C1
InChI KeyWUMCWUULWWVQGT-UHFFFAOYSA-N
SynonymTERT-BUTYL 3-ISOTHIOCYANATOBENZOATE;3-(TERT-BUTOXYCARBONYL)PHENYL ISOTHIOCYANATE;Benzoic acid, 3-isothiocyanato-, 1,1-dimethylethyl ester
CAS No.486415-53-6

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. ACPLYB897 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. ACCVMA913 route compound structure diagram
    ACCVMA91392146-82-2 In Stock
  2. Plus
  3. reactant_2 route compound structure diagram
    --
  4. Then
  5. ACPLYB897 route product structure diagram
    ACPLYB897486415-53-6
Inquiry

2. ACPLYB897 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. ACCVMA913 route compound structure diagram
    ACCVMA91392146-82-2 In Stock
  2. Plus
  3. reactant_2 route compound structure diagram
    --
  4. Then
  5. ACPLYB897 route product structure diagram
    ACPLYB897486415-53-6
Inquiry

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