CAS:660440-57-3 / (4-(3-ethoxy-3-oxopropyl)phenyl)boronic acid--Hangzhou Chempro Technology Co., Ltd.

CAS Number: 660440-57-3
(4-(3-ethoxy-3-oxopropyl)phenyl)boronic acid

Structure
Name: (4-(3-ethoxy-3-oxopropyl)phenyl)boronic acid
Synonyms:

General Information

Product Number: 660440573

CAS Registry Number: 660440-57-3

Name:

Benzenepropanoic acid, 4-borono-, 1-ethyl ester

Benzenepropanoic acid, 4-borono-, α-ethyl ester (9CI); [4(2-Ethoxycarbonylethyl)phenyl]boronic acid; [4-(3-Ethoxy-3-oxopropyl)phenyl]boronic acid

Chemical Formula: C11H15BO4

Exact Mass: 222.11

Molecular Weight: 222.05

m/z: 222.11 (100.0%), 221.11 (24.1%), 223.11 (12.1%), 224.11 (1.4%)

Elemental Analysis: C, 59.50; H, 6.81; B, 4.87; O, 28.82

InChI: InChI=1S/C11H15BO4/c1-2-16-11(13)8-5-9-3-6-10(7-4-9)12(14)15/h3-4,6-7,14-15H,2,5,8H2,1H3

InChIKey: PRCOGZNDLWXGHB-UHFFFAOYSA-N

Canonical SMILES : B(C1=CC=C(C=C1)CCC(=O)OCC)(O)O

Specification

98%

References

(2) Predicted NMR data calculated using Advanced Chemistry Development, Inc. (ACD/Labs) Software V11.01 (© 1994-2014 ACD/Labs)

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