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Structure

4-Bromothiophene-2-boronic acid pinacol ester

CAS
942070-06-6
Catalog Number
ACM942070066
Category
Other Products
Molecular Weight
289
Molecular Formula
C10H14BBrO2S

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Specification

Synonyms
4-BROMOTHIOPHENE-2-BORONIC ACID PINACOL ESTER;4-BROMOTHIOPHEN-2-BORONIC ACID PINACOL ESTER
What is the molecular formula of 4-Bromothiophene-2-boronic acid pinacol ester?

The molecular formula is C10H14BBrO2S.

When was 4-Bromothiophene-2-boronic acid pinacol ester created?

It was created on October 30, 2011.

What is the IUPAC name of 4-Bromothiophene-2-boronic acid pinacol ester?

The IUPAC name is 2-(4-bromothiophen-2-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane.

What is the InChI of 4-Bromothiophene-2-boronic acid pinacol ester?

The InChI is "InChI=1S/C10H14BBrO2S/c1-9(2)10(3,4)14-11(13-9)8-5-7(12)6-15-8/h5-6H,1-4H3".

What is the InChIKey of 4-Bromothiophene-2-boronic acid pinacol ester?

The InChIKey is "XOLVNUOSAPZSLF-UHFFFAOYSA-N".

What is the canonical SMILES of 4-Bromothiophene-2-boronic acid pinacol ester?

The canonical SMILES is "B1(OC(C(O1)(C)C)(C)C)C2=CC(=CS2)Br".

What is the CAS number of 4-Bromothiophene-2-boronic acid pinacol ester?

The CAS number is 942070-06-6.

What is the molecular weight of 4-Bromothiophene-2-boronic acid pinacol ester?

The molecular weight is 289.00 g/mol.

What is the hydrogen bond donor count of 4-Bromothiophene-2-boronic acid pinacol ester?

The hydrogen bond donor count is 0.

Is 4-Bromothiophene-2-boronic acid pinacol ester canonicalized?

Yes, it is canonicalized according to PubChem.

Upstream Synthesis Route 1

  • 872-31-1
  • 25015-63-8
  • 942070-06-6
  • 1040281-99-9

Reference: [1]Chotana, Ghayoor A.; Kallepalli, Venkata A.; Maleczka Jr., Robert E.; Smith III, Milton R.
[Tetrahedron, 2008, vol. 64, # 26, p. 6103 - 6114]

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