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5-Acetyl-3-thienylboronic acid

CAS
942190-74-1
Catalog Number
ACM942190741
Category
Boronic Acids

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What is the molecular formula of 5-Acetyl-3-thienylboronic acid?

The molecular formula of 5-Acetyl-3-thienylboronic acid is C6H7BO3S.

What is the molecular weight of 5-Acetyl-3-thienylboronic acid?

The molecular weight of 5-Acetyl-3-thienylboronic acid is 170.00 g/mol.

What is the IUPAC name of 5-Acetyl-3-thienylboronic acid?

The IUPAC name of 5-Acetyl-3-thienylboronic acid is (5-acetylthiophen-3-yl)boronic acid.

What is the InChI of 5-Acetyl-3-thienylboronic acid?

The InChI of 5-Acetyl-3-thienylboronic acid is InChI=1S/C6H7BO3S/c1-4(8)6-2-5(3-11-6)7(9)10/h2-3,9-10H,1H3.

What is the InChIKey of 5-Acetyl-3-thienylboronic acid?

The InChIKey of 5-Acetyl-3-thienylboronic acid is ABXWZNDYRCDJSC-UHFFFAOYSA-N.

What is the canonical SMILES of 5-Acetyl-3-thienylboronic acid?

The canonical SMILES of 5-Acetyl-3-thienylboronic acid is B(C1=CSC(=C1)C(=O)C)(O)O.

How many hydrogen bond donor counts are there in 5-Acetyl-3-thienylboronic acid?

There are 2 hydrogen bond donor counts in 5-Acetyl-3-thienylboronic acid.

How many hydrogen bond acceptor counts are there in 5-Acetyl-3-thienylboronic acid?

There are 4 hydrogen bond acceptor counts in 5-Acetyl-3-thienylboronic acid.

How many rotatable bond counts are there in 5-Acetyl-3-thienylboronic acid?

There are 2 rotatable bond counts in 5-Acetyl-3-thienylboronic acid.

Is 5-Acetyl-3-thienylboronic acid the canonicalized form?

Yes, 5-Acetyl-3-thienylboronic acid is the canonicalized form.

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