3-Butylbenzonitrile

Catalog No. :
ACBSZR028
CAS No. :
20651-74-5
Molecular Formula :
C11H13N
Molecular Weight :
159.23

IUPAC Name:3-butylbenzonitrile

3-Butylbenzonitrile structure diagram
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Product Information

Product Name3-Butylbenzonitrile
IUPAC Name3-butylbenzonitrile
MDL No.MFCD20233386
Molecular FormulaC11H13N
Molecular Weight159.23
SMILESCCCCC1=CC(C#N)=CC=C1
InChI KeyKHTOSIUCQBUWHE-UHFFFAOYSA-N
Synonym3-Butylbenzonitrile;Benzonitrile, 3-butyl-
CAS No.20651-74-5

Safety Data

Pictogram
Harmful or irritant
Signal Word
Achtung
Hazard Statement(s)
H315-H319
Precautionary Statement(s)
P264-P280-P302+P352-P305+P351+P338-P332+P313-P337+P313-P362

Synthetic Route by SureRoute

1. ACBSZR028 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Then
  3. ACBSZR028 route product structure diagram
    ACBSZR02820651-74-5
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2. ACBSZR028 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Plus
  3. ACTRMX927 route compound structure diagram
    ACTRMX927555-75-9
  4. Plus
  5. reactant_3 route compound structure diagram
    --
  6. Then
  7. ACBSZR028 route product structure diagram
    ACBSZR02820651-74-5
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