CAS:475102-11-5 / (1-(tert-butoxycarbonyl)-4-chloro-1H-indol-2-yl)boronic acidCanonical SMILES B(C1=CC2=C(N1C(=O)OC(C)(C)C)C=CC=C2Cl)(O)O--Hangzhou Chempro Technology Co., Ltd.

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CAS Number: 475102-11-5
(1-(tert-butoxycarbonyl)-4-chloro-1H-indol-2-yl)boronic acidCanonical SMILES B(C1=CC2=C(N1C(=O)OC(C)(C)C)C=CC=C2Cl)(O)O

Structure
Name: (1-(tert-butoxycarbonyl)-4-chloro-1H-indol-2-yl)boronic acidCanonical SMILES B(C1=CC2=C(N1C(=O)OC(C)(C)C)C=CC=C2Cl)(O)O
Synonyms:

General Information

Product Number: 475102115

CAS Registry Number 475102-11-5
Name:
1H-Indole-1-carboxylic acid, 2-borono-4-chloro-, 1-(1,1-dimethylethyl) ester

Chemical Formula: C13H15BClNO4
Exact Mass: 295.08
Molecular Weight: 295.53
m/z: 295.08 (100.0%), 297.08 (34.9%), 294.08 (24.8%), 296.08 (22.7%), 298.08 (4.7%), 295.09 (3.6%)

InChI:InChI=1S/C13H15BClNO4/c1-13(2,3)20-12(17)16-10-6-4-5-9(15)8(10)7-11(16)14(18)19/h4-7,18-19H,1-3H3

InChI Key:HUWASNXIUPJIJH-UHFFFAOYSA-N

Canonical SMILES:B(C1=CC2=C(N1C(=O)OC(C)(C)C)C=CC=C2Cl)(O)O

Specification

98%

References

PCT Int. Appl. (2013), WO 2013087643 A1 20130620.

PCT Int. Appl. (2009), WO 2009008992 A2 20090115.

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