3-Methylbenzylisothiocyanate

Catalog No. :
ACRCJL359
CAS No. :
3696-66-0
Molecular Formula :
C9H9NS
Molecular Weight :
163.24

IUPAC Name:1-(isothiocyanatomethyl)-3-methylbenzene

3-Methylbenzylisothiocyanate structure diagram
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Product Information

Product Name3-Methylbenzylisothiocyanate
IUPAC Name1-(isothiocyanatomethyl)-3-methylbenzene
MDL No.MFCD00060410
Molecular FormulaC9H9NS
Molecular Weight163.24
SMILESCC1=CC(CN=C=S)=CC=C1
InChI KeyNUXFAFWRXGFTQJ-UHFFFAOYSA-N
Synonym3-Methylbenzyl isothiocyanate | 3696-66-0 | 1-(Isothiocyanatomethyl)-3-methylbenzene | Benzene, 1-(isothiocyanatomethyl)-3-methyl- | Benzene,1-(isothiocyanatomethyl)-3-methyl- | SCHEMBL2341886 | DTXSID20190457 | NUXFAFWRXGFTQJ-UHFFFAOYSA-N | GEO-02500 | MFCD00060410 | AKOS01
CAS No.3696-66-0
PubChem CID138010

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. ACRCJL359 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. ACRCJL359 route product structure diagram
    ACRCJL3593696-66-0
Inquiry

2. ACRCJL359 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. ACRCJL359 route product structure diagram
    ACRCJL3593696-66-0
Inquiry

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