Methyl 5-hexyl-1-[4-phenyl-6-(trifluoromethyl)pyrimidin-2-yl]-1H-1,2,3-triazole-4-carboxylate

Catalog No. :
ACNDMB523
CAS No. :
861210-45-9
Molecular Formula :
C21H22F3N5O2
Molecular Weight :
433.43

IUPAC Name:methyl 5-hexyl-1-(4-phenyl-6-(trifluoromethyl)pyrimidin-2-yl)-1H-1,2,3-triazole-4-carboxylate

Methyl 5-hexyl-1-[4-phenyl-6-(trifluoromethyl)pyrimidin-2-yl]-1H-1,2,3-triazole-4-carboxylate structure diagram
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Product Information

Product NameMethyl 5-hexyl-1-[4-phenyl-6-(trifluoromethyl)pyrimidin-2-yl]-1H-1,2,3-triazole-4-carboxylate
IUPAC Namemethyl 5-hexyl-1-(4-phenyl-6-(trifluoromethyl)pyrimidin-2-yl)-1H-1,2,3-triazole-4-carboxylate
MDL No.MFCD03787555
Molecular FormulaC21H22F3N5O2
Molecular Weight433.43
SMILESO=C(C1=C(CCCCCC)N(C2=NC(C(F)(F)F)=CC(C3=CC=CC=C3)=N2)N=N1)OC
InChI KeyZABQZJNQRIKYGA-UHFFFAOYSA-N
SynonymMETHYL 5-HEXYL-1-[4-PHENYL-6-(TRIFLUOROMETHYL)-2-PYRIMIDINYL]-1H-1,2,3-TRIAZOLE-4-CARBOXYLATE;methyl 5-hexyl-1-[4-phenyl-6-(trifluoromethyl)pyrimidin-2-yl]-1H-1,2,3-triazole-4-carboxylate;1H-1,2,3-Triazole-4-carboxylic acid, 5-hexyl-1-[4-phenyl-6-(trifluoromethyl)-2-pyrimidinyl]-, methyl ester
CAS No.861210-45-9

Safety Data

Pictogram
Harmful or irritant
Signal Word
Achtung
Hazard Statement(s)
H302-H315-H319-H335
Precautionary Statement(s)
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P330-P362-P403+P233-P501

Synthetic Route by SureRoute

1. ACNDMB523 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. ACVXOW632 route compound structure diagram
    ACVXOW632111-80-8 In Stock
  2. Plus
  3. reactant_2 route compound structure diagram
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  4. Then
  5. ACNDMB523 route product structure diagram
    ACNDMB523861210-45-9
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2. ACNDMB523 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
    --
  4. Then
  5. ACNDMB523 route product structure diagram
    ACNDMB523861210-45-9
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