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Structure

4-Bromo-1-(pyridin-4-ylmethyl)-1H-pyrazole

CAS
1179798-11-8
Catalog Number
ACM1179798118-1
Category
Other

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What is the molecular formula of the compound with PubChem CID 46739711?

The molecular formula is C9H8BrN3.

What is the molecular weight of the compound?

The molecular weight is 238.08 g/mol.

What is the IUPAC name of the compound?

The IUPAC name is 4-[(4-bromopyrazol-1-yl)methyl]pyridine.

What is the InChIKey of the compound?

The InChIKey is XDBLWTXWXBNOCJ-UHFFFAOYSA-N.

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

There are 0 hydrogen bond donor counts.

What is the topological polar surface area of the compound?

The topological polar surface area is 30.7 Ų.

Is the compound Is Canonicalized?

Yes, the compound is canonicalized.

What is the XLogP3-AA value of the compound?

The XLogP3-AA value is 1.4.

How many rotatable bond counts are there in the compound?

There are 2 rotatable bond counts.

What is the CAS number of the compound?

The CAS number is 1179798-11-8.

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