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Structure

1-(5-Chloro-2-benzoxazolyl)-4-piperidinecarboxylic acid

CAS
936074-51-0
Catalog Number
ACM936074510
Category
Other Products
Molecular Weight
280.71
Molecular Formula
C13H13ClN2O3

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Specification

Synonyms
1-(5-Chloro-2-benzoxazolyl)-4-piperidinecarboxylic acid;1-(5-Chlorobenzo[d]oxazol-2-yl)piperidine-4-carboxylic acid
Density
1.431
What is the molecular formula of the compound?

The molecular formula of the compound is C13H13ClN2O3.

What are the synonyms of the compound?

The synonyms of the compound include 1-(5-CHLOROBENZO[D]OXAZOL-2-YL)PIPERIDINE-4-CARBOXYLIC ACID and 1-(5-Chloro-2-benzoxazolyl)-4-piperidinecarboxylic acid.

When was the compound created and last modified?

The compound was created on November 13, 2007, and last modified on December 30, 2023.

What is the InChIKey of the compound?

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

How many hydrogen bond donor counts does the compound have?

The compound has 1 hydrogen bond donor count.

What is the XLogP3 value of the compound?

The XLogP3 value of the compound is 3.3.

What is the topological polar surface area of the compound?

The topological polar surface area of the compound is 66.6 Ų.

How many rotatable bond counts does the compound have?

The compound has 2 rotatable bond counts.

Is the compound canonicalized?

Yes, the compound is canonicalized.

What is the molecular weight of the compound?

The molecular weight of the compound is 280.70 g/mol.

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