B-[5-Chloro-1-[(4-methylphenyl)sulfonyl]-1H-pyrrolo[2,3-b]pyridin-3-yl]boronic acid

CAS Registry Number®

1417422-00-4
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CAS Name

B-[5-Chloro-1-[(4-methylphenyl)sulfonyl]-1H-pyrrolo[2,3-b]pyridin-3-yl]boronic acid

Molecular Formula

C14H12BClN2O4S

Molecular Mass

350.59

Cite this Page

B-[5-Chloro-1-[(4-methylphenyl)sulfonyl]-1H-pyrrolo[2,3-b]pyridin-3-yl]boronic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1417422-00-4 (retrieved 2024-09-06) (CAS RN: 1417422-00-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C14H12BClN2O4S/c1-9-2-4-11(5-3-9)23(21,22)18-8-13(15(19)20)12-6-10(16)7-17-14(12)18/h2-8,19-20H,1H3

InChIKey

InChIKey=RBKQSKSGWGOASE-UHFFFAOYSA-N

SMILES

S(=O)(=O)(N1C=2C(C(B(O)O)=C1)=CC(Cl)=CN2)C3=CC=C(C)C=C3

Canonical SMILES

O=S(=O)(C1=CC=C(C=C1)C)N2C=C(B(O)O)C=3C=C(Cl)C=NC32

Other Names for this Substance

  • Boronic acid, B-[5-chloro-1-[(4-methylphenyl)sulfonyl]-1H-pyrrolo[2,3-b]pyridin-3-yl]-
  • B-[5-Chloro-1-[(4-methylphenyl)sulfonyl]-1H-pyrrolo[2,3-b]pyridin-3-yl]boronic acid
  • [5-Chloro-1-(4-methylbenzenesulfonyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]boronic acid
  • (5-Chloro-1-tosyl-1H-pyrrolo[2,3-b]pyridin-3-yl)boronic acid