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Structure

[(5-Bromopyridine-2-carbonyl)-amino]-acetic acid methyl ester

CAS
915394-66-0
Catalog Number
ACM915394660
Category
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What is the molecular formula of [(5-Bromopyridine-2-carbonyl)-amino]-acetic acid methyl ester according to the reference?

The molecular formula is C9H9BrN2O3.

When was the compound created and modified?

The compound was created on 2012-10-22 and modified on 2023-12-30.

What is the IUPAC Name of the compound?

The IUPAC Name is methyl 2-[(5-bromopyridine-2-carbonyl)amino]acetate.

What is the InChIKey of the compound?

The InChIKey is JBYSGPBPFKIBLX-UHFFFAOYSA-N.

How many hydrogen bond donor counts are there in the compound?

There is 1 hydrogen bond donor count in the compound.

What is the topological polar surface area of the compound?

The topological polar surface area is 68.3 Å2.

How many defined atom stereocenter counts are in the compound?

There are 0 defined atom stereocenter counts in the compound.

What is the covalently-bonded unit count of the compound?

The covalently-bonded unit count is 1.

What is the XLogP3-AA value of the compound?

The XLogP3-AA value is 1.1.

Is the compound canonicalized according to PubChem?

Yes, the compound is canonicalized according to PubChem.

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