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CAS Number: 465515-31-5
5-boronothiophene-2-carboxylic acid

Structure

5-boronothiophene-2-carboxylic acid
Name: 5-boronothiophene-2-carboxylic acid
Synonyms:
General Information
Product Number: 465515315
CAS Registry Number: 465515-31-5
Name:
        2-​Thiophenecarboxylic acid, 5-​borono-
        (5-​Carboxythien-​2-​yl)​boronic acid; 5-​(Dihydroxyboryl)​-​2-​thiophenecarboxylic acid; 5-​Boronothiophene-​2-​carboxylic acid; 5-​Carboxy-​2-​thiopheneboronic acid 
 
Chemical Formula: C5H5BO4S
Exact Mass: 172.00
Molecular Weight: 171.97
m/z: 172.00 (100.0%), 171.00 (24.8%), 173.00 (7.5%), 174.00 (5.4%), 172.01 (1.4%)
Elemental Analysis: C, 34.92; H, 2.93; B, 6.29; O, 37.22; S, 18.65
 
InChI: InChI=1S/C5H5BO4S/c7-5(8)3-1-2-4(11-3)6(9)10/h1-2,9-10H,(H,7,8)
InChIKey: OQGIKNPOYTVNNF-UHFFFAOYSA-N
Canonical SMILES : B(C1=CC=C(S1)C(=O)O)(O)O

Specification

98%

References

PCT Int. Appl. (2014), WO 2014011935 A1 20140116.  

PCT Int. Appl. (2013), WO 2013175053 A1 20131128.

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