![[3,6-Dichloro-2-(3-chloro-2-oxopropyl)phenyl] acetate structure](/static/products/139/139548-94-0.png)
[3,6-Dichloro-2-(3-chloro-2-oxopropyl)phenyl] acetate
TL;DR: [3,6-Dichloro-2-(3-chloro-2-oxopropyl)phenyl] acetate (CAS 139548-94-0) is a chemical compound with molecular formula C11H9Cl3O3 and molecular weight 293.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3,6-dichloro-2-(3-chloro-2-oxopropyl)phenyl] acetate
Also Known As: 2-Propanone, 1-[2-(acetyloxy)-3,6-dichlorophenyl]-3-chloro-, [3,6-dichloro-2-(3-chloro-2-oxo-propyl)phenyl] Acetate, 1-[2-(Acetyloxy)-3,6-dichlorophenyl]-3-chloro-2-propanone
| Molecular Formula | C11H9Cl3O3 |
|---|---|
| Molecular Weight | 293.96 g/mol |
| LogP | 3.2691 |
| Topological Polar Surface Area | 43.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 293.96173 |
| Heavy Atoms | 17 |
| Complexity | 457.52002 |
Chemical Identifiers
| CAS Number | 139548-94-0 |
|---|---|
| SMILES | CC(=O)OC1=C(C=CC(=C1CC(=O)CCl)Cl)Cl |
Product Overview
[3,6-Dichloro-2-(3-chloro-2-oxopropyl)phenyl] acetate (CAS 139548-94-0), with molecular formula C11H9Cl3O3 and molecular weight 293.96 g/mol. IUPAC: [3,6-dichloro-2-(3-chloro-2-oxopropyl)phenyl] acetate.
Chemical Property Profile of [3,6-Dichloro-2-(3-chloro-2-oxopropyl)phenyl] acetate
Property Insights of [3,6-Dichloro-2-(3-chloro-2-oxopropyl)phenyl] acetate
The XLogP value of 3.2691 indicates that [3,6-Dichloro-2-(3-chloro-2-oxopropyl)phenyl] acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.37 Ų, [3,6-Dichloro-2-(3-chloro-2-oxopropyl)phenyl] acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [3,6-Dichloro-2-(3-chloro-2-oxopropyl)phenyl] acetate has 0 hydrogen bond donor(s) and 3 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 [3,6-Dichloro-2-(3-chloro-2-oxopropyl)phenyl] acetate?
The CAS number of [3,6-Dichloro-2-(3-chloro-2-oxopropyl)phenyl] acetate is 139548-94-0.
What is the molecular formula of [3,6-Dichloro-2-(3-chloro-2-oxopropyl)phenyl] acetate?
The molecular formula of [3,6-Dichloro-2-(3-chloro-2-oxopropyl)phenyl] acetate is C11H9Cl3O3.
What is the molecular weight of [3,6-Dichloro-2-(3-chloro-2-oxopropyl)phenyl] acetate?
The molecular weight of [3,6-Dichloro-2-(3-chloro-2-oxopropyl)phenyl] acetate is 293.96 g/mol.
Where can I buy [3,6-Dichloro-2-(3-chloro-2-oxopropyl)phenyl] acetate?
You can request a quote for [3,6-Dichloro-2-(3-chloro-2-oxopropyl)phenyl] acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [3,6-Dichloro-2-(3-chloro-2-oxopropyl)phenyl] acetate?
Yes, KEHONG BIO provides custom synthesis services for [3,6-Dichloro-2-(3-chloro-2-oxopropyl)phenyl] acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.