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CAS Number: 475102-15-9
(1-(tert-butoxycarbonyl)-5-cyano-1H-indol-2-yl)boronic acid

Structure

(1-(tert-butoxycarbonyl)-5-cyano-1H-indol-2-yl)boronic acid
Name: (1-(tert-butoxycarbonyl)-5-cyano-1H-indol-2-yl)boronic acid
Synonyms:
General Information
Product Number: 475102159

CAS Registry Number 475102-15-9
Name:
1H-​Indole-​1-​carboxylic acid, 2-​borono-​5-​cyano-​, 1-​(1,​1-​dimethylethyl) ester
(1-Boc-5-cyanoindol-2-yl)boronic acid
[1-(tert-Butoxycarbonyl)-5-cyanoindol-2-yl]boronic acid
[N-(tert-Butoxycarbonyl)-5-cyanoindol-2-yl]boronic acid

 

Chemical Formula: C14H15BN2O4
Exact Mass: 286.11
Molecular Weight: 286.09
m/z: 286.11 (100.0%), 285.12 (24.8%), 287.12 (15.9%), 286.12 (3.8%), 288.12 (2.0%)

 

InChI:InChI=1S/C14H15BN2O4/c1-14(2,3)21-13(18)17-11-5-4-9(8-16)6-10(11)7-12(17)15(19)20/h4-7,19-20H,1-3H3

InChI Key:AJWYBPNMPKTRDV-UHFFFAOYSA-N

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

Specification

98%

References

PCT Int. Appl. (2013), WO 2013010904 A1 20130124.                                  

PCT Int. Appl. (2012), WO 2012001107 A1 20120105.                                 

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