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Structure

2-(2,5-Dichlorophenyl)piperazine

CAS
914348-91-7
Catalog Number
ACM914348917
Category
Other Products
Molecular Weight
231.12
Molecular Formula
C10H12Cl2N2

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Specification

Synonyms
2-(2,5-DICHLOROPHENYL)PIPERAZINE
IUPAC Name
2-(2,5-dichlorophenyl)piperazine
Canonical SMILES
C1CNC(CN1)C2=C(C=CC(=C2)Cl)Cl
InChI Key
PAZPHGORPPQSTL-UHFFFAOYSA-N
Boiling Point
328.4ºC at 760 mmHg
Flash Point
152.4ºC
Density
1.238g/cm³
Exact Mass
230.03800
H-Bond Acceptor
2
H-Bond Donor
2
What is the molecular formula of 2-(2,5-Dichlorophenyl)piperazine?

The molecular formula is C10H12Cl2N2.

When was this compound created and modified according to PubChem?

It was created on March 29, 2010, and last modified on December 30, 2023.

What is the IUPAC name of 2-(2,5-Dichlorophenyl)piperazine?

The IUPAC name is 2-(2,5-dichlorophenyl)piperazine.

What is the InChIKey of this compound?

The InChIKey is PAZPHGORPPQSTL-UHFFFAOYSA-N.

What is the Canonical SMILES representation of this compound?

The Canonical SMILES is C1CNC(CN1)C2=C(C=CC(=C2)Cl)Cl.

What is the molecular weight of 2-(2,5-Dichlorophenyl)piperazine?

The molecular weight is 231.12 g/mol.

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

There are 2 hydrogen bond donor counts.

What is the topological polar surface area of this compound?

The topological polar surface area is 24.1 Ų.

How many heavy atoms are present in 2-(2,5-Dichlorophenyl)piperazine?

There are 14 heavy atoms.

Is the compound canonicalized according to PubChem?

Yes, the compound is canonicalized.

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