Structure

5-Bromo-2-(2-carboxybenzamido)benzoic acid

CAS
924905-87-3
Catalog Number
ACM924905873
Category
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What is the molecular formula of 5-Bromo-2-(2-carboxybenzamido)benzoic acid?

The molecular formula is C15H10BrNO5.

When was 5-Bromo-2-(2-carboxybenzamido)benzoic acid created and last modified in the database?

It was created on 2009-05-28 and last modified on 2023-12-30.

What is the IUPAC Name of 5-Bromo-2-(2-carboxybenzamido)benzoic acid?

The IUPAC Name is 5-bromo-2-[(2-carboxybenzoyl)amino]benzoic acid.

What is the InChI of 5-Bromo-2-(2-carboxybenzamido)benzoic acid?

The InChI is InChI=1S/C15H10BrNO5/c16-8-5-6-12(11(7-8)15(21)22)17-13(18)9-3-1-2-4-10(9)14(19)20/h1-7H,(H,17,18)(H,19,20)(H,21,22).

What is the InChIKey of 5-Bromo-2-(2-carboxybenzamido)benzoic acid?

The InChIKey is CZHNRPOPMADPAK-UHFFFAOYSA-N.

How many hydrogen bond donor counts does 5-Bromo-2-(2-carboxybenzamido)benzoic acid have?

It has 3 hydrogen bond donor counts.

What is the topological polar surface area of 5-Bromo-2-(2-carboxybenzamido)benzoic acid?

The topological polar surface area is 104 Å^2.

What is the XLogP3-AA value of 5-Bromo-2-(2-carboxybenzamido)benzoic acid?

The XLogP3-AA value is 3.1.

How many rotatable bond counts does 5-Bromo-2-(2-carboxybenzamido)benzoic acid have?

It has 4 rotatable bond counts.

Is 5-Bromo-2-(2-carboxybenzamido)benzoic acid a canonicalized compound?

Yes, the compound is canonicalized.

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