2,2-Dimethylpropyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzenesulfonate

CAS Registry Number®

648905-68-4
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CAS Name

2,2-Dimethylpropyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzenesulfonate

Molecular Formula

C17H27BO5S

Molecular Mass

354.27

Cite this Page

2,2-Dimethylpropyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzenesulfonate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=648905-68-4 (retrieved 2024-09-01) (CAS RN: 648905-68-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C17H27BO5S/c1-15(2,3)12-21-24(19,20)14-10-8-13(9-11-14)18-22-16(4,5)17(6,7)23-18/h8-11H,12H2,1-7H3

InChIKey

InChIKey=JVTCSFFRORKXNX-UHFFFAOYSA-N

SMILES

CC1(C)OB(OC1(C)C)C2=CC=C(S(OCC(C)(C)C)(=O)=O)C=C2

Canonical SMILES

O=S(=O)(OCC(C)(C)C)C1=CC=C(C=C1)B2OC(C)(C)C(O2)(C)C

Other Names for this Substance

  • Benzenesulfonic acid, 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-, 2,2-dimethylpropyl ester
  • 2,2-Dimethylpropyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzenesulfonate
  • 4-(4,4,5,5-Tetramethyl-[1,3,2]dioxaborolan-2-yl)benzenesulfonic acid 2,2-dimethylpropyl ester
  • Neopentyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzenesulfonate

Deleted or Replaced CAS Registry Numbers

2675398-50-0