5-Cyanothiophene-2-boronic acid

• CAS: 305832-67-1
• Catalog Number: ACM305832671
• Category: Thiophenes
• Molecular Weight: 152.97
• Molecular Formula: C5H4BNO2S
• Synonyms: (5-Cyanothiophen-2-Yl)Boronic Acid; 5-Cyanothiophen-2-Ylboronic Acid
• Melting Point: 175-180°C(lit.)
• Appearance: Solid

Custom Q&A

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

The molecular formula of 5-Cyanothiophene-2-boronic acid is C5H4BNO2S.

When was the structure of 5-Cyanothiophene-2-boronic acid created?

The structure of 5-Cyanothiophene-2-boronic acid was created on September 13, 2005.

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

The IUPAC name of 5-Cyanothiophene-2-boronic acid is (5-cyanothiophen-2-yl)boronic acid.

What is the InChIKey of 5-Cyanothiophene-2-boronic acid?

The InChIKey of 5-Cyanothiophene-2-boronic acid is ZEOMEPSYIIQIND-UHFFFAOYSA-N.

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

The Canonical SMILES of 5-Cyanothiophene-2-boronic acid is B(C1=CC=C(S1)C#N)(O)O.

What is the CAS ID of 5-Cyanothiophene-2-boronic acid?

The CAS ID of 5-Cyanothiophene-2-boronic acid is 305832-67-1.

How many hydrogen bond donor counts are in 5-Cyanothiophene-2-boronic acid?

There are 2 hydrogen bond donor counts in 5-Cyanothiophene-2-boronic acid.

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

The topological polar surface area of 5-Cyanothiophene-2-boronic acid is 92.5 Å^2.

Is the compound canonicalized for 5-Cyanothiophene-2-boronic acid?

Yes, the compound is canonicalized for 5-Cyanothiophene-2-boronic acid.

What is the complexity value for 5-Cyanothiophene-2-boronic acid?

The complexity value for 5-Cyanothiophene-2-boronic acid is 166.

Synthetic Use

Upstream Synthesis Route 1

• 1003-31-2

• 305832-67-1

Reference: [1] Patent: US6355648, 2002, B1, . Location in patent: Page column 64