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CAS Number: 475102-13-7
(5-bromo-1-(tert-butoxycarbonyl)-1H-indol-2-yl)boronic acid

Structure

(5-bromo-1-(tert-butoxycarbonyl)-1H-indol-2-yl)boronic acid
Name: (5-bromo-1-(tert-butoxycarbonyl)-1H-indol-2-yl)boronic acid
Synonyms:
General Information
Product Number: 475102137

CAS Registry Number 475102-13-7
Name:
1H-​Indole-​1-​carboxylic acid, 2-​borono-​5-​bromo-​, 1-​(1,​1-​dimethylethyl) ester
1-Boc-5-bromoindole-2-boronic acid
2-Borono-5-bromo-1H-indole-1-carboxylic acid tert-butyl ester
[5-Bromo-1-(tert-butoxycarbonyl)-1H-indol-2-yl]boronic acid

 

Chemical Formula: C13H15BBrNO4
Exact Mass: 339.03
Molecular Weight: 339.98
m/z: 339.03 (100.0%), 341.03 (99.0%), 340.03 (37.2%), 338.03 (24.0%), 342.03 (13.7%), 343.03 (1.7%)

 

InChI:InChI=1S/C13H15BBrNO4/c1-13(2,3)20-12(17)16-10-5-4-9(15)6-8(10)7-11(16)14(18)19/h4-7,18-19H,1-3H3

InChI Key:RBYTXZMVOGZESQ-UHFFFAOYSA-N

Canonical SMILES:B(C1=CC2=C(N1C(=O)OC(C)(C)C)C=CC(=C2)Br)(O)O

Specification

98%

References

PCT Int. Appl. (2010), WO 2010045188 A1 20100422.                                 

PCT Int. Appl. (2008), WO 2008047831 A1 20080424.

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