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CAS Number: 849833-86-9
(3-fluoro-4-(methylcarbamoyl)phenyl)boronic acid

Structure

(3-fluoro-4-(methylcarbamoyl)phenyl)boronic acid
Name: (3-fluoro-4-(methylcarbamoyl)phenyl)boronic acid
Synonyms:
General Information
Product Number: 849833869
CAS Registry Number: 849833-86-9
Name:
        Boronic acid, B-​[3-​fluoro-​4-​[(methylamino)​carbonyl]​phenyl]​-
        Boronic acid, [3-​fluoro-​4-​[(methylamino)​carbonyl]​phenyl]​- (9CI); [3-​Fluoro-​4-​(methylcarbamoyl)​phenyl]​boronic acid 
 
Chemical Formula: C8H9BFNO3
Exact Mass: 197.07
Molecular Weight: 196.97
m/z: 197.07 (100.0%), 196.07 (24.3%), 198.07 (8.8%)
Elemental Analysis: C, 48.78; H, 4.61; B, 5.49; F, 9.65; N, 7.11; O, 24.37
 
InChI: InChI=1S/C8H9BFNO3/c1-11-8(12)6-3-2-5(9(13)14)4-7(6)10/h2-4,13-14H,1H3,(H,11,12)
InChIKey: IVSXSBGNMOZTJR-UHFFFAOYSA-N
Canonical SMILES : B(C1=CC(=C(C=C1)C(=O)NC)F)(O)O

Specification

98%

References

PCT Int. Appl. (2014), WO 2014026125 A1 20140213.                                 

PCT Int. Appl. (2013), WO 2013188724 A1 20131219.

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