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CAS Number: 454185-96-7
(4-(2-methoxy-2-oxoethyl)phenyl)boronic acid

Structure

(4-(2-methoxy-2-oxoethyl)phenyl)boronic acid
Name: (4-(2-methoxy-2-oxoethyl)phenyl)boronic acid
Synonyms:
General Information
Product Number: 454185967
CAS Registry Number: 454185-96-7
Name:
        Benzeneacetic acid, 4-​borono-​, 1-​methyl ester
        Benzeneacetic acid, 4-​borono-​, α-​methyl ester (9CI); 4-​(2-​Methoxy-​2-​oxo-​ethyl)​benzeneboronic acid; 4-​Boronobenzeneacetic acid methyl ester; [4-​(2-​Methoxy-​2-​oxoethyl)​phenyl]​boronic acid 
 
Chemical Formula: C9H11BO4
Exact Mass: 194.08
Molecular Weight: 193.99
m/z: 194.08 (100.0%), 193.08 (24.2%), 195.08 (10.0%), 196.08 (1.2%)
Elemental Analysis: C, 55.72; H, 5.72; B, 5.57; O, 32.99
 
InChI: InChI=1S/C9H11BO4/c1-14-9(11)6-7-2-4-8(5-3-7)10(12)13/h2-5,12-13H,6H2,1H3
InChIKey: CKXOGMXYISAZGN-UHFFFAOYSA-N
Canonical SMILES : B(C1=CC=C(C=C1)CC(=O)OC)(O)O

Specification

98%

References
  1. (1) Hattori, Kouji; WO 2004002939 A2 2004 CAPLUS
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