3-[4-(tert-butoxycarbonyl)piperazin-1-yl]phenylboronic acid pinacol ester

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Catalog Number

ACMA00014846

Product Name

3-[4-(tert-butoxycarbonyl)piperazin-1-yl]phenylboronic acid pinacol ester

Category

Salt

IUPAC Name

tert-butyl 4-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]piperazine-1-carboxylate

Molecular Weight

388.3g/mol

Molecular Formula

C21H33BN2O4

Canonical SMILES

B1(OC(C(O1)(C)C)(C)C)C2=CC(=CC=C2)N3CCN(CC3)C(=O)OC(C)(C)C

InChI

InChI=1S/C21H33BN2O4/c1-19(2,3)26-18(25)24-13-11-23(12-14-24)17-10-8-9-16(15-17)22-27-20(4,5)21(6,7)28-22/h8-10,15H,11-14H2,1-7H3

InChI Key

RJUYJGNYCCEDAH-UHFFFAOYSA-N

Complexity

551

Covalently-Bonded Unit Count

Exact Mass

388.253338g/mol

Formal Charge

Heavy Atom Count

Monoisotopic Mass

388.253338g/mol

Rotatable Bond Count

MSDS

COA

Spec Sheet

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