tert-Butyl 4-isothiocyanatobenzoate

Catalog No. :
ACGWUH411
CAS No. :
486415-37-6
Molecular Formula :
C12H13NO2S
Molecular Weight :
235.31

IUPAC Name:tert-butyl 4-isothiocyanatobenzoate

tert-Butyl 4-isothiocyanatobenzoate structure diagram
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Product Information

Product Nametert-Butyl 4-isothiocyanatobenzoate
IUPAC Nametert-butyl 4-isothiocyanatobenzoate
MDL No.MFCD03453226
Molecular FormulaC12H13NO2S
Molecular Weight235.31
SMILESO=C(OC(C)(C)C)C1=CC=C(N=C=S)C=C1
InChI KeyLXVVKZRNRVNESX-UHFFFAOYSA-N
Synonym4-(TERT-BUTOXYCARBONYL)PHENYL ISOTHIOCYANATE;tert-Butyl 4-isothiocyanatobenzoate >=97.0% (HPLC);TERT-BUTYL 4-ISOTHIOCYANATOBENZOATE;4-isothiocyanato-benzoic acid tert-butyl ester;Benzoic acid, 4-isothiocyanato-, 1,1-dimethylethyl ester;ert-butyl4-isothiocyanatobenzoate;tert-Butyl 4-isothiocyanatobenzoate
CAS No.486415-37-6

Safety Data

Pictogram
ToxicHealth hazard
Signal Word
Gefahr
Hazard Statement(s)
H315-H317-H319-H330-H334-H335-H351-H412
Precautionary Statement(s)
P201-P202-P260-P264-P271-P272-P273-P280-P284-P302+P352-P304+P340+P310-P305+P351+P338-P308+P313-P333+P313-P337+P313-P403+P233-P405-P501

Synthetic Route by SureRoute

1. ACGWUH411 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. ACRCAV237 route compound structure diagram
    ACRCAV23718144-47-3 In Stock
  2. Plus
  3. reactant_2 route compound structure diagram
    --
  4. Then
  5. ACGWUH411 route product structure diagram
    ACGWUH411486415-37-6
Inquiry

2. ACGWUH411 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. ACRCAV237 route compound structure diagram
    ACRCAV23718144-47-3 In Stock
  2. Plus
  3. reactant_2 route compound structure diagram
    --
  4. Then
  5. ACGWUH411 route product structure diagram
    ACGWUH411486415-37-6
Inquiry

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