2-Chloro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoic acid

CAS Registry Number®

936728-21-1

CAS Name

2-Chloro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoic acid

Molecular Formula

C13H16BClO4

Molecular Mass

282.53

Cite this Page

2-Chloro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=936728-21-1 (retrieved 2024-12-02) (CAS RN: 936728-21-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C13H16BClO4/c1-12(2)13(3,4)19-14(18-12)8-5-6-10(15)9(7-8)11(16)17/h5-7H,1-4H3,(H,16,17)

InChIKey

InChIKey=VUWPWVQNFRBOLI-UHFFFAOYSA-N

SMILES

CC1(C)OB(OC1(C)C)C2=CC(C(O)=O)=C(Cl)C=C2

Canonical SMILES

O=C(O)C1=CC(=CC=C1Cl)B2OC(C)(C)C(O2)(C)C

Other Names for this Substance

  • Benzoic acid, 2-chloro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
  • 2-Chloro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoic acid

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