1-(2,2-Dimethylpropyl) 2-borono-4-bromobenzoate

CAS Registry Number®

1309980-79-7

CAS Name

1-(2,2-Dimethylpropyl) 2-borono-4-bromobenzoate

Molecular Formula

C12H16BBrO4

Molecular Mass

314.97

Cite this Page

1-(2,2-Dimethylpropyl) 2-borono-4-bromobenzoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1309980-79-7 (retrieved 2024-11-25) (CAS RN: 1309980-79-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C12H16BBrO4/c1-12(2,3)7-18-11(15)9-5-4-8(14)6-10(9)13(16)17/h4-6,16-17H,7H2,1-3H3

InChIKey

InChIKey=PFQQZEMAZQNSCZ-UHFFFAOYSA-N

SMILES

C(OCC(C)(C)C)(=O)C1=C(B(O)O)C=C(Br)C=C1

Canonical SMILES

O=C(OCC(C)(C)C)C1=CC=C(Br)C=C1B(O)O

Other Names for this Substance

  • Benzoic acid, 2-borono-4-bromo-, 1-(2,2-dimethylpropyl) ester
  • 1-(2,2-Dimethylpropyl) 2-borono-4-bromobenzoate
  • 5-Bromo-2-[(neopentyloxy)carbonyl]phenylboronic acid
  • [5-Bromo-2-[(2,2-dimethylpropoxy)carbonyl]phenyl]boronic acid

CAS INSIGHTSTM
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