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Product Overview

Product Code

TRC-D479803

CAS Number

937796-06-0

Product Format

Neat

Molecular Formula

C21 H22 O12

Molecular Weight

466.392

Product Categories

TRC, Building Blocks

Product Type

Synthesis Tools

Documentation

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Product Information

Chemical Data

Analyte Name

4-(3,5-Dimethylpyrazol-1-yl)phenylboronic acid, pinacol ester

CAS Number

937796-06-0

Molecular Formula

C21 H22 O12

Molecular Weight

466.392

Accurate Mass

466.111

SMILES

OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c2c(O)cc3O[C@H]([C@H](O)C(=O)c3c2O)c4ccc(O)c(O)c4

InChI

InChI=1S/C21H22O12/c22-5-11-14(26)17(29)19(31)21(33-11)12-9(25)4-10-13(15(12)27)16(28)18(30)20(32-10)6-1-2-7(23)8(24)3-6/h1-4,11,14,17-27,29-31H,5H2/t11-,14-,17+,18-,19-,20+,21+/m1/s1

IUPAC

(2S,3S)-2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-6-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-2,3-dihydrochromen-4-one

Product Data

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

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Chemical Data

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4-(3,5-Dimethylpyrazol-1-yl)phenylboronic acid, pinacol ester

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