2-Chloro-1-(4-prop-2-enylpiperazin-1-yl)ethanone
TL;DR: 2-Chloro-1-(4-prop-2-enylpiperazin-1-yl)ethanone (CAS 86780-40-7) is a chemical compound with molecular formula C9H15ClN2O and molecular weight 202.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-1-(4-prop-2-enylpiperazin-1-yl)ethanone
Also Known As: Piperazine,1- -4- -, 2-chloro-1-(4-prop-2-enylpiperazin-1-yl)ethanone, 1-(4-ALLYL-PIPERAZIN-1-YL)-2-CHLORO-ETHANONE, PIPERAZINE, 1-(CHLOROACETYL)-4-(2-PROPENYL)-, Piperazine, 1-(chloroacetyl)-4-(2-propenyl)- (9CI)
| Molecular Formula | C9H15ClN2O |
|---|---|
| Molecular Weight | 202.09 g/mol |
| LogP | 0.5554 |
| Topological Polar Surface Area | 23.55 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 202.0873 |
| Heavy Atoms | 13 |
| Complexity | 188.05373 |
Chemical Identifiers
| CAS Number | 86780-40-7 |
|---|---|
| SMILES | C=CCN1CCN(CC1)C(=O)CCl |
Product Overview
2-Chloro-1-(4-prop-2-enylpiperazin-1-yl)ethanone (CAS 86780-40-7), with molecular formula C9H15ClN2O and molecular weight 202.09 g/mol. IUPAC: 2-chloro-1-(4-prop-2-enylpiperazin-1-yl)ethanone.
Chemical Property Profile of 2-Chloro-1-(4-prop-2-enylpiperazin-1-yl)ethanone
Property Insights of 2-Chloro-1-(4-prop-2-enylpiperazin-1-yl)ethanone
The XLogP value of 0.5554 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Chloro-1-(4-prop-2-enylpiperazin-1-yl)ethanone. With a topological polar surface area (TPSA) of 23.55 Ų, 2-Chloro-1-(4-prop-2-enylpiperazin-1-yl)ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chloro-1-(4-prop-2-enylpiperazin-1-yl)ethanone 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 2-Chloro-1-(4-prop-2-enylpiperazin-1-yl)ethanone?
The CAS number of 2-Chloro-1-(4-prop-2-enylpiperazin-1-yl)ethanone is 86780-40-7.
What is the molecular formula of 2-Chloro-1-(4-prop-2-enylpiperazin-1-yl)ethanone?
The molecular formula of 2-Chloro-1-(4-prop-2-enylpiperazin-1-yl)ethanone is C9H15ClN2O.
What is the molecular weight of 2-Chloro-1-(4-prop-2-enylpiperazin-1-yl)ethanone?
The molecular weight of 2-Chloro-1-(4-prop-2-enylpiperazin-1-yl)ethanone is 202.09 g/mol.
Where can I buy 2-Chloro-1-(4-prop-2-enylpiperazin-1-yl)ethanone?
You can request a quote for 2-Chloro-1-(4-prop-2-enylpiperazin-1-yl)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chloro-1-(4-prop-2-enylpiperazin-1-yl)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloro-1-(4-prop-2-enylpiperazin-1-yl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.