5-Hydroxymethylthiophene-2-boronic acid

• CAS: 338454-45-8
• Catalog Number: ACM338454458
• Category: Boronic Acids
• Molecular Weight: 157.98
• Molecular Formula: C₅H₇O₃BS
• Synonyms: 5-HYDROXYMETHYLTHIOPHENE-2-BORONIC ACID

Custom Q&A

What is the molecular formula of 5-Hydroxymethylthiophene-2-boronic acid?

The molecular formula is C5H7BO3S.

What is the molecular weight of 5-Hydroxymethylthiophene-2-boronic acid?

The molecular weight is 157.99 g/mol.

When was 5-Hydroxymethylthiophene-2-boronic acid created?

It was created on September 14, 2005.

What is the IUPAC name of 5-Hydroxymethylthiophene-2-boronic acid?

The IUPAC name is [5-(hydroxymethyl)thiophen-2-yl]boronic acid.

What is the InChI of 5-Hydroxymethylthiophene-2-boronic acid?

The InChI is InChI=1S/C5H7BO3S/c7-3-4-1-2-5(10-4)6(8)9/h1-2,7-9H,3H2.

What is the Canonical SMILES of 5-Hydroxymethylthiophene-2-boronic acid?

The Canonical SMILES is B(C1=CC=C(S1)CO)(O)O.

What is the CAS number of 5-Hydroxymethylthiophene-2-boronic acid?

The CAS number is 338454-45-8.

How many hydrogen bond donor counts does 5-Hydroxymethylthiophene-2-boronic acid have?

It has 3 hydrogen bond donor counts.

What is the topological polar surface area of 5-Hydroxymethylthiophene-2-boronic acid?

The topological polar surface area is 88.9Ų.

Is 5-Hydroxymethylthiophene-2-boronic acid a canonicalized compound?

Yes, it is a canonicalized compound.

Synthetic Use

Upstream Synthesis Route 1

• 636-72-6

• 338454-45-8

Reference: [1] Patent: US6821980, 2004, B1, . Location in patent: Page column 30-31

Upstream Synthesis Route 2

• 636-72-6

• 338454-45-8

Reference: [1]Patent: US6821980,2004,B1 .Location in patent: Page column 30-31