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Structure

1-(2-Chloropropionyl)-4-(2-methoxyphenyl)piperazine

CAS
95395-48-5
Catalog Number
ACM95395485
Category
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What is the molecular formula of the compound with PubChem CID 3781014?

The molecular formula is C14H19ClN2O2.

What is the molecular weight of the compound?

The molecular weight is 282.76 g/mol.

What is the IUPAC name of the compound?

The IUPAC name is 2-chloro-1-[4-(2-methoxyphenyl)piperazin-1-yl]propan-1-one.

What is the InChIKey of the compound?

The InChIKey is IBWLZKLBOVBADW-UHFFFAOYSA-N.

How many hydrogen bond acceptors does the compound have?

The compound has 3 hydrogen bond acceptors.

What is the topological polar surface area of the compound?

The topological polar surface area is 32.8 Å2.

How many rotatable bonds does the compound have?

The compound has 3 rotatable bonds.

Is the compound canonicalized?

Yes, the compound is canonicalized.

What is the XLogP3-AA value of the compound?

The XLogP3-AA value is 2.3.

When was the compound last modified in PubChem?

The compound was last modified on December 30, 2023.

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