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Structure

Boronic acid,b-(2-cyano-5-thiazolyl)-

CAS
947281-57-4
Catalog Number
ACM947281574
Category
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What is the molecular formula of boronic acid, b-(2-cyano-5-thiazolyl)?

The molecular formula is C4H3BN2O2S.

What are the synonyms for boronic acid, b-(2-cyano-5-thiazolyl)?

The synonyms include (2-cyanothiazol-5-yl)boronic acid, 947281-57-4, (2-cyano-1,3-thiazol-5-yl)boronic acid, (2-cyanothiazol-5-yl)boronic acid, and AT32204.

What is the molecular weight of boronic acid, b-(2-cyano-5-thiazolyl)?

The molecular weight is 153.96 g/mol.

What is the IUPAC name of boronic acid, b-(2-cyano-5-thiazolyl)?

The IUPAC name is (2-cyano-1,3-thiazol-5-yl)boronic acid.

What is the InChI of boronic acid, b-(2-cyano-5-thiazolyl)?

The InChI is InChI=1S/C4H3BN2O2S/c6-1-4-7-2-3(10-4)5(8)9/h2,8-9H.

What is the InChIKey of boronic acid, b-(2-cyano-5-thiazolyl)?

The InChIKey is PAVOVVZTACKJIQ-UHFFFAOYSA-N.

What is the canonical SMILES of boronic acid, b-(2-cyano-5-thiazolyl)?

The canonical SMILES is B(C1=CN=C(S1)C#N)(O)O.

How many hydrogen bond donor counts does boronic acid, b-(2-cyano-5-thiazolyl) have?

It has 2 hydrogen bond donor counts.

How many hydrogen bond acceptor counts does boronic acid, b-(2-cyano-5-thiazolyl) have?

It has 5 hydrogen bond acceptor counts.

What is the topological polar surface area of boronic acid, b-(2-cyano-5-thiazolyl)?

The topological polar surface area is 105 Ų.

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