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4-Methoxycarbonyl-3-(trifluoromethyl)phenylboronic acid pinacol ester

CAS
1045795-70-7
Catalog Number
ACM1045795707
Category
Boronic Esters

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What is the molecular formula of 4-Methoxycarbonyl-3-(trifluoromethyl)phenylboronic acid pinacol ester?

The molecular formula is C15H18BF3O4.

When was 4-Methoxycarbonyl-3-(trifluoromethyl)phenylboronic acid pinacol ester first created on PubChem?

It was first created on October 30, 2011.

What is the IUPAC name of 4-Methoxycarbonyl-3-(trifluoromethyl)phenylboronic acid pinacol ester?

The IUPAC name is methyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(trifluoromethyl)benzoate.

What is the InChIKey of 4-Methoxycarbonyl-3-(trifluoromethyl)phenylboronic acid pinacol ester?

The InChIKey is FKZBIAASSSCFDM-UHFFFAOYSA-N.

How many hydrogen bond donor counts are there in 4-Methoxycarbonyl-3-(trifluoromethyl)phenylboronic acid pinacol ester?

There are 0 hydrogen bond donor counts.

What is the topological polar surface area of 4-Methoxycarbonyl-3-(trifluoromethyl)phenylboronic acid pinacol ester?

The topological polar surface area is 44.8Ų.

How many heavy atoms are there in 4-Methoxycarbonyl-3-(trifluoromethyl)phenylboronic acid pinacol ester?

There are 23 heavy atoms.

Is 4-Methoxycarbonyl-3-(trifluoromethyl)phenylboronic acid pinacol ester a canonicalized compound?

Yes, it is a canonicalized compound.

What is the monoisotopic mass of 4-Methoxycarbonyl-3-(trifluoromethyl)phenylboronic acid pinacol ester?

The monoisotopic mass is 330.1250237 g/mol.

How many rotatable bond counts are there in 4-Methoxycarbonyl-3-(trifluoromethyl)phenylboronic acid pinacol ester?

There are 3 rotatable bond counts.

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