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CAS Number: 253280-21-6
(4,4''-di-tert-butyl-[1,1':3',1''-terphenyl]-5'-yl)boronic acid

Structure

(4,4''-di-tert-butyl-[1,1':3',1''-terphenyl]-5'-yl)boronic acid
Name: (4,4''-di-tert-butyl-[1,1':3',1''-terphenyl]-5'-yl)boronic acid
Synonyms:
General Information
Product Number: 253280216

CAS Registry Number 253280-21-6
Name:
Boronic acid, B-​[4,​4''-​bis(1,​1-​dimethylethyl)​[1,​1':3',​1''-​terphenyl]​-​5'-​yl]​-
Boronic acid, [4,4''-bis(1,1-dimethylethyl)[1,1':3',1''-terphenyl]-5'-yl]- (9CI)
3,5-Di(4-tert-butylphenyl)phenylboronic acid

 

Chemical Formula: C26H31BO2
Exact Mass: 386.24
Molecular Weight: 386.33
m/z: 386.24 (100.0%), 387.25 (29.6%), 385.25 (24.8%), 386.25 (7.1%), 388.25 (4.4%)

 

InChI:InChI=1S/C26H31BO2/c1-25(2,3)22-11-7-18(8-12-22)20-15-21(17-24(16-20)27(28)29)19-9-13-23(14-10-19)26(4,5)6/h7-17,28-29H,1-6H3

InChI Key:UMHOYNYTAJQYMD-UHFFFAOYSA-N

Canonical SMILES:B(C1=CC(=CC(=C1)C2=CC=C(C=C2)C(C)(C)C)C3=CC=C(C=C3)C(C)(C)C)(O)O

Specification

98%

References

PCT Int. Appl. (2014), WO 2014023377 A2 20140213. 

PCT Int. Appl. (2013), WO 2013108699 A1 20130725.

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