5-Acetylthiophene-2-boronic acid pinacol ester

CAS

942070-32-8

Catalog Number

ACM942070328

Category

Other Products

Molecular Weight

270.15286

Molecular Formula

C₁₂H₁₇BO₃S

MSDS COA Spec Sheet

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Specification

Synonyms

5-ACETYLTHIOPHENE-2-BORONIC ACID PINACOL ESTER

IUPAC Name

1-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)thiophen-2-yl]ethanone

Canonical SMILES

B1(OC(C(O1)(C)C)(C)C)C2=CC=C(S2)C(=O)C

InChI Key

NQCVKFAFBSIAPA-UHFFFAOYSA-N

Exact Mass

252.09900

H-Bond Acceptor

H-Bond Donor

What is the PubChem CID of 5-Acetylthiophene-2-boronic acid pinacol ester?

The PubChem CID of 5-Acetylthiophene-2-boronic acid pinacol ester is 53398602.

What is the molecular formula of 5-Acetylthiophene-2-boronic acid pinacol ester?

The molecular formula of 5-Acetylthiophene-2-boronic acid pinacol ester is C12H17BO3S.

What are the synonyms of 5-Acetylthiophene-2-boronic acid pinacol ester?

The synonyms of 5-Acetylthiophene-2-boronic acid pinacol ester are 942070-32-8, 1-(5-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)THIOPHEN-2-YL)ETHANONE, and 1-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)thiophen-2-yl]ethanone.

What is the molecular weight of 5-Acetylthiophene-2-boronic acid pinacol ester?

The molecular weight of 5-Acetylthiophene-2-boronic acid pinacol ester is 252.14 g/mol.

What is the IUPAC name of 5-Acetylthiophene-2-boronic acid pinacol ester?

The IUPAC name of 5-Acetylthiophene-2-boronic acid pinacol ester is 1-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)thiophen-2-yl]ethanone.

What is the InChI of 5-Acetylthiophene-2-boronic acid pinacol ester?

The InChI of 5-Acetylthiophene-2-boronic acid pinacol ester is InChI=1S/C12H17BO3S/c1-8(14)9-6-7-10(17-9)13-15-11(2,3)12(4,5)16-13/h6-7H,1-5H3.

What is the InChIKey of 5-Acetylthiophene-2-boronic acid pinacol ester?

The InChIKey of 5-Acetylthiophene-2-boronic acid pinacol ester is NQCVKFAFBSIAPA-UHFFFAOYSA-N.

What is the canonical SMILES of 5-Acetylthiophene-2-boronic acid pinacol ester?

The canonical SMILES of 5-Acetylthiophene-2-boronic acid pinacol ester is B1(OC(C(O1)(C)C)(C)C)C2=CC=C(S2)C(=O)C.

What is the CAS number of 5-Acetylthiophene-2-boronic acid pinacol ester?

The CAS number of 5-Acetylthiophene-2-boronic acid pinacol ester is 942070-32-8.

Is 5-Acetylthiophene-2-boronic acid pinacol ester canonicalized?

Yes, 5-Acetylthiophene-2-boronic acid pinacol ester is canonicalized.

Upstream Synthesis Route 1

88-15-3
25015-63-8

942070-32-8

Reference: [1]Tetrahedron,2008,vol. 64,p. 6103 - 6114

Downstream Synthesis Route 1

942070-32-8
1266480-24-3

1266478-02-7

Reference: [1]Patent: WO2011/19405,2011,A1 .Location in patent: Page/Page column 160

Downstream Synthesis Route 2

942070-32-8

1266478-09-4
1266478-12-9

Reference: [1]Patent: WO2011/19405,2011,A1

* For details of the synthesis route, please refer to the original source to ensure accuracy.