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CAS Number: 1040281-86-4
methyl 5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)thiophene-3-carboxylate

Structure

methyl 5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)thiophene-3-carboxylate
Name: methyl 5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)thiophene-3-carboxylate
Synonyms:
General Information
Product Number: 1040281864

CAS Registry Number 1040281-86-4
Name:
3-​Thiophenecarboxylic acid, 5-​(4,​4,​5,​5-​tetramethyl-​1,​3,​2-​dioxaborolan-​2-​yl)​-​, methyl ester
Methyl 5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)thiophene-3-carboxylate

 

Chemical Formula: C12H17BO4S
Exact Mass: 268.09
Molecular Weight: 268.14
m/z: 268.09 (100.0%), 267.10 (24.8%), 269.10 (13.7%), 270.09 (4.5%), 268.10 (3.5%), 269.09 (1.9%), 270.10 (1.9%)

 

InChI:InChI=1S/C12H17BO4S/c1-11(2)12(3,4)17-13(16-11)9-6-8(7-18-9)10(14)15-5/h6-7H,1-5H3

InChI Key:ZJFOCNXPSJTTFP-UHFFFAOYSA-N

Canonical SMILES:B1(OC(C(O1)(C)C)(C)C)C2=CC(=CS2)C(=O)OC

 

Thermal Properties Value Condition Note
Melting Point 84-85 °C   (1)CAS

Specification

98%

References

(1) Chotana, Ghayoor A.; Tetrahedron 2008, V64(26), P6103-6114 CAPLUS

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