Piperazine, 1,4-bis(2-chloroethyl)-
TL;DR: Piperazine, 1,4-bis(2-chloroethyl)- (CAS 1009-85-4) is a chemical compound with molecular formula C8H16Cl2N2 and molecular weight 210.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,4-bis(2-chloroethyl)piperazine
Also Known As: 1,4-Bis(2-chloroethyl)piperazine, Piperazine, 1,4-bis(2-chloroethyl)-, PIPERAZINE,1,4-BIS(2-CHLOROETHYL)-, N,N'-Bis(2-chloroethyl)piperazine, Vortioxetine Impurity 63
| Molecular Formula | C8H16Cl2N2 |
|---|---|
| Molecular Weight | 210.07 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 6.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 210.06906 |
| Heavy Atoms | 12 |
| Complexity | 99.0 |
Chemical Identifiers
| CAS Number | 1009-85-4 |
|---|---|
| SMILES | C1CN(CCN1CCCl)CCCl |
| InChIKey | JPFYIYQIGQYIMC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Piperazine, 1,4-bis(2-chloroethyl)- (CAS 1009-85-4), with molecular formula C8H16Cl2N2 and molecular weight 210.07 g/mol. IUPAC: 1,4-bis(2-chloroethyl)piperazine.
Chemical Property Profile of Piperazine, 1,4-bis(2-chloroethyl)-
Property Insights of Piperazine, 1,4-bis(2-chloroethyl)-
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Piperazine, 1,4-bis(2-chloroethyl)-. With a topological polar surface area (TPSA) of 6.5 Ų, Piperazine, 1,4-bis(2-chloroethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Piperazine, 1,4-bis(2-chloroethyl)- has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Piperazine, 1,4-bis(2-chloroethyl)-?
The CAS number of Piperazine, 1,4-bis(2-chloroethyl)- is 1009-85-4.
What is the molecular formula of Piperazine, 1,4-bis(2-chloroethyl)-?
The molecular formula of Piperazine, 1,4-bis(2-chloroethyl)- is C8H16Cl2N2.
What is the molecular weight of Piperazine, 1,4-bis(2-chloroethyl)-?
The molecular weight of Piperazine, 1,4-bis(2-chloroethyl)- is 210.07 g/mol.
Where can I buy Piperazine, 1,4-bis(2-chloroethyl)-?
You can request a quote for Piperazine, 1,4-bis(2-chloroethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Piperazine, 1,4-bis(2-chloroethyl)-?
Yes, KEHONG BIO provides custom synthesis services for Piperazine, 1,4-bis(2-chloroethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.