1-(1,1-Dimethylethyl) 2-borono-5-cyano-1H-indole-1-carboxylate

CAS Registry Number®

475102-15-9

CAS Name

1-(1,1-Dimethylethyl) 2-borono-5-cyano-1H-indole-1-carboxylate

Molecular Formula

C14H15BN2O4

Molecular Mass

286.09

Cite this Page

1-(1,1-Dimethylethyl) 2-borono-5-cyano-1H-indole-1-carboxylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=475102-15-9 (retrieved 2024-11-21) (CAS RN: 475102-15-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    245-248 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C14H15BN2O4/c1-14(2,3)21-13(18)17-11-5-4-9(8-16)6-10(11)7-12(17)15(19)20/h4-7,19-20H,1-3H3

InChIKey

InChIKey=AJWYBPNMPKTRDV-UHFFFAOYSA-N

SMILES

C(OC(C)(C)C)(=O)N1C=2C(C=C1B(O)O)=CC(C#N)=CC2

Canonical SMILES

N#CC=1C=CC2=C(C1)C=C(B(O)O)N2C(=O)OC(C)(C)C

Other Names for this Substance

  • 1H-Indole-1-carboxylic acid, 2-borono-5-cyano-, 1-(1,1-dimethylethyl) ester
  • 1-(1,1-Dimethylethyl) 2-borono-5-cyano-1H-indole-1-carboxylate
  • [N-(tert-Butoxycarbonyl)-5-cyanoindol-2-yl]boronic acid
  • [1-(tert-Butoxycarbonyl)-5-cyanoindol-2-yl]boronic acid
  • (1-Boc-5-cyanoindol-2-yl)boronic acid

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CAS INSIGHTSTM
Targeted protein degrader structure, illustration