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Structure

4-[2-(4-Carboxyphenoxy)ethoxy]-3-chlorobenzoic acid

CAS
94023-72-0
Catalog Number
ACM94023720
Category
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What is the molecular formula of the compound?

The molecular formula of the compound is C16H13ClO6.

When was the compound created and last modified?

The compound was created on August 8, 2005, and last modified on December 30, 2023.

What is the IUPAC name of the compound?

The IUPAC name of the compound is 4-[2-(4-carboxyphenoxy)ethoxy]-3-chlorobenzoic acid.

What is the InChIKey of the compound?

The InChIKey of the compound is ZOTIAGGMDTXJIW-UHFFFAOYSA-N.

How many hydrogen bond donor counts does the compound have?

The compound has 2 hydrogen bond donor counts.

What is the exact mass of the compound?

The exact mass of the compound is 336.0400658 g/mol.

How many rotatable bond counts does the compound have?

The compound has 7 rotatable bond counts.

What is the topological polar surface area of the compound?

The topological polar surface area of the compound is 93.1 Å^2.

Is the compound canonicalized?

Yes, the compound is canonicalized.

What is the complexity value of the compound?

The complexity value of the compound is 407.

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