![[(Z)-5-(3,4-dichlorophenyl)-4-nitropent-4-enyl] acetate structure](/static/products/215/21559-76-2.png)
[(Z)-5-(3,4-dichlorophenyl)-4-nitropent-4-enyl] acetate
TL;DR: [(Z)-5-(3,4-dichlorophenyl)-4-nitropent-4-enyl] acetate (CAS 21559-76-2) is a chemical compound with molecular formula C13H13Cl2NO4 and molecular weight 317.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(Z)-5-(3,4-dichlorophenyl)-4-nitropent-4-enyl] acetate
Also Known As: 5-(3,4-dichlorophenyl)-4-nitropent-4-en-1-yl acetate, [(Z)-5-(3,4-dichlorophenyl)-4-nitropent-4-enyl] acetate
| Molecular Formula | C13H13Cl2NO4 |
|---|---|
| Molecular Weight | 317.02 g/mol |
| LogP | 3.9543 |
| Topological Polar Surface Area | 69.44 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 317.02216 |
| Heavy Atoms | 20 |
| Complexity | 543.1727 |
Chemical Identifiers
| CAS Number | 21559-76-2 |
|---|---|
| SMILES | CC(=O)OCCC/C(=C/C1=CC(=C(C=C1)Cl)Cl)/[N+](=O)[O-] |
Product Overview
[(Z)-5-(3,4-dichlorophenyl)-4-nitropent-4-enyl] acetate (CAS 21559-76-2), with molecular formula C13H13Cl2NO4 and molecular weight 317.02 g/mol. IUPAC: [(Z)-5-(3,4-dichlorophenyl)-4-nitropent-4-enyl] acetate.
Chemical Property Profile of [(Z)-5-(3,4-dichlorophenyl)-4-nitropent-4-enyl] acetate
Property Insights of [(Z)-5-(3,4-dichlorophenyl)-4-nitropent-4-enyl] acetate
The XLogP value of 3.9543 indicates that [(Z)-5-(3,4-dichlorophenyl)-4-nitropent-4-enyl] acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.44 Ų falls within the moderate polarity range, balancing permeability and solubility for [(Z)-5-(3,4-dichlorophenyl)-4-nitropent-4-enyl] acetate. Following Lipinski's Rule of Five, [(Z)-5-(3,4-dichlorophenyl)-4-nitropent-4-enyl] acetate has 0 hydrogen bond donor(s) and 4 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 [(Z)-5-(3,4-dichlorophenyl)-4-nitropent-4-enyl] acetate?
The CAS number of [(Z)-5-(3,4-dichlorophenyl)-4-nitropent-4-enyl] acetate is 21559-76-2.
What is the molecular formula of [(Z)-5-(3,4-dichlorophenyl)-4-nitropent-4-enyl] acetate?
The molecular formula of [(Z)-5-(3,4-dichlorophenyl)-4-nitropent-4-enyl] acetate is C13H13Cl2NO4.
What is the molecular weight of [(Z)-5-(3,4-dichlorophenyl)-4-nitropent-4-enyl] acetate?
The molecular weight of [(Z)-5-(3,4-dichlorophenyl)-4-nitropent-4-enyl] acetate is 317.02 g/mol.
Where can I buy [(Z)-5-(3,4-dichlorophenyl)-4-nitropent-4-enyl] acetate?
You can request a quote for [(Z)-5-(3,4-dichlorophenyl)-4-nitropent-4-enyl] acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(Z)-5-(3,4-dichlorophenyl)-4-nitropent-4-enyl] acetate?
Yes, KEHONG BIO provides custom synthesis services for [(Z)-5-(3,4-dichlorophenyl)-4-nitropent-4-enyl] acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.