Methyl 3-nitro-4-(phenylethynyl)benzoate

Catalog No. :
ACHKFO817
CAS No. :
1321627-86-4
Molecular Formula :
C16H11NO4
Molecular Weight :
281.27

IUPAC Name:methyl 3-nitro-4-(phenylethynyl)benzoate

Methyl 3-nitro-4-(phenylethynyl)benzoate structure diagram
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Product Information

Product NameMethyl 3-nitro-4-(phenylethynyl)benzoate
IUPAC Namemethyl 3-nitro-4-(phenylethynyl)benzoate
Molecular FormulaC16H11NO4
Molecular Weight281.27
SMILESO=C(OC)C1=CC=C(C#CC2=CC=CC=C2)C([N+]([O-])=O)=C1
InChI KeyAPKOQVUGOBDGFK-UHFFFAOYSA-N
SynonymBenzoic acid, 3-nitro-4-(2-phenylethynyl)-, methyl ester
CAS No.1321627-86-4

Synthetic Route by SureRoute

1. ACHKFO817 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Plus
  3. ACOWPI630 route compound structure diagram
    ACOWPI6302363-16-8 In Stock
  4. Then
  5. ACHKFO817 route product structure diagram
    ACHKFO8171321627-86-4
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2. ACHKFO817 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Plus
  3. ACMOFB695 route compound structure diagram
    ACMOFB69589976-27-2
  4. Then
  5. ACHKFO817 route product structure diagram
    ACHKFO8171321627-86-4
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