1,1-Dimethylethyl 4-[3-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)benzoyl]-1-piperazinecarboxylate

CAS Registry Number®

1036991-36-2
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CAS Name

1,1-Dimethylethyl 4-[3-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)benzoyl]-1-piperazinecarboxylate

Molecular Formula

C21H31BN2O5

Molecular Mass

402.29

Cite this Page

1,1-Dimethylethyl 4-[3-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)benzoyl]-1-piperazinecarboxylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1036991-36-2 (retrieved 2024-08-15) (CAS RN: 1036991-36-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C21H31BN2O5/c1-20(2,3)29-19(26)24-11-9-23(10-12-24)18(25)16-7-6-8-17(13-16)22-27-14-21(4,5)15-28-22/h6-8,13H,9-12,14-15H2,1-5H3

InChIKey

InChIKey=JTBZBTONKAVWNS-UHFFFAOYSA-N

SMILES

C(=O)(C=1C=C(C=CC1)B2OCC(C)(C)CO2)N3CCN(C(OC(C)(C)C)=O)CC3

Canonical SMILES

O=C(OC(C)(C)C)N1CCN(C(=O)C=2C=CC=C(C2)B3OCC(C)(C)CO3)CC1

Other Names for this Substance

  • 1-Piperazinecarboxylic acid, 4-[3-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)benzoyl]-, 1,1-dimethylethyl ester
  • 1,1-Dimethylethyl 4-[3-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)benzoyl]-1-piperazinecarboxylate