Benzyl 4-chloro-3-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)benzoate

Catalog No. :
ACENKT590
CAS No. :
2096997-42-9
Molecular Formula :
C19H20BClO4
Molecular Weight :
358.63

IUPAC Name:benzyl 4-chloro-3-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)benzoate

Benzyl 4-chloro-3-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)benzoate structure diagram
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Product Information

Product NameBenzyl 4-chloro-3-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)benzoate
IUPAC Namebenzyl 4-chloro-3-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)benzoate
MDL No.MFCD09952766
Molecular FormulaC19H20BClO4
Molecular Weight358.63
SMILESO=C(C1=CC=C(C(B2OCC(C)(CO2)C)=C1)Cl)OCC3=CC=CC=C3
InChI KeyPTWIOVJHQURFBU-UHFFFAOYSA-N
SynonymBenzoic acid, 4-chloro-3-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)-, phenylmethyl ester;Phenylmethyl 4-chloro-3-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)benzoate
CAS No.2096997-42-9

Safety Data

Pictogram
Harmful or irritant
Signal Word
Achtung
Hazard Statement(s)
H302-H315-H319
Precautionary Statement(s)
P264-P270-P280-P301+P312+P330-P302+P352-P305+P351+P338-P332+P313-P337+P313-P362+P364-P501

Synthetic Route by SureRoute

1. ACENKT590 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
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  3. reactant_2 route compound structure diagram
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  4. Then
  5. ACENKT590 route product structure diagram
    ACENKT5902096997-42-9
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2. ACENKT590 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. ACENKT590 route product structure diagram
    ACENKT5902096997-42-9
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