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Piperazine, 1,4-bis(2-chloroethyl)-, hydrochloride (1:1) structure
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Piperazine, 1,4-bis(2-chloroethyl)-, hydrochloride (1:1)

TL;DR: Piperazine, 1,4-bis(2-chloroethyl)-, hydrochloride (1:1) (CAS 63980-44-9) is a chemical compound with molecular formula C8H17Cl3N2 and molecular weight 246.04573 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

1,4-bis(2-chloroethyl)piperazine;hydrochloride

Also Known As: Piperazine, 1,4-bis(2-chloroethyl)-, hydrochloride, N,N'-Bis(2-chloroethyl)-1,4-piperazine hydrochloride, 1,4-bis(2-chloroethyl)piperazine hydrochloride, 1,4-bis(2-chloroethyl)piperazine,hydrochloride, Piperazine,4-bis(2-chloroethyl)-, dihydrochloride

CAS Number
63980-44-9
Molecular Formula
C8H17Cl3N2
Molecular Weight
246.04573 g/mol
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Technical Specifications

Molecular FormulaC8H17Cl3N2
Molecular Weight246.04573 g/mol
XLogP1.5
Topological Polar Surface Area (TPSA)6.5 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors2
Rotatable Bonds4
Exact Mass246.04573 Da
Heavy Atoms13
Complexity99.0
SMILESC1CN(CCN1CCCl)CCCl.Cl
InChIKeyZWLBXJPWDFNUSC-UHFFFAOYSA-N

Chemical Property Profile of Piperazine, 1,4-bis(2-chloroethyl)-, hydrochloride (1:1)

XLogP
1.5
TPSA (Topological Polar Surface Area)
6.5
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
2
Rotatable Bonds
4
Heavy Atoms
13
Complexity
99.0
Exact Mass
246.04573
Monoisotopic Mass
246.04573
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of Piperazine, 1,4-bis(2-chloroethyl)-, hydrochloride (1:1)

The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Piperazine, 1,4-bis(2-chloroethyl)-, hydrochloride (1:1). With a topological polar surface area (TPSA) of 6.5 Ų, Piperazine, 1,4-bis(2-chloroethyl)-, hydrochloride (1:1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Piperazine, 1,4-bis(2-chloroethyl)-, hydrochloride (1:1) has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of Piperazine, 1,4-bis(2-chloroethyl)-, hydrochloride (1:1)?

The CAS number of Piperazine, 1,4-bis(2-chloroethyl)-, hydrochloride (1:1) is 63980-44-9.

What is the molecular formula of Piperazine, 1,4-bis(2-chloroethyl)-, hydrochloride (1:1)?

The molecular formula of Piperazine, 1,4-bis(2-chloroethyl)-, hydrochloride (1:1) is C8H17Cl3N2.

What is the molecular weight of Piperazine, 1,4-bis(2-chloroethyl)-, hydrochloride (1:1)?

The molecular weight of Piperazine, 1,4-bis(2-chloroethyl)-, hydrochloride (1:1) is 246.04573 g/mol.

Where can I buy Piperazine, 1,4-bis(2-chloroethyl)-, hydrochloride (1:1)?

You can request a quote for Piperazine, 1,4-bis(2-chloroethyl)-, hydrochloride (1:1) directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Piperazine, 1,4-bis(2-chloroethyl)-, hydrochloride (1:1)?

Yes, CoreyChem provides custom synthesis services for Piperazine, 1,4-bis(2-chloroethyl)-, hydrochloride (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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