ethyl 2-[2,4-dichloro-5-(1H-pyrrol-1-yl)phenoxy]acetate
TL;DR: ethyl 2-[2,4-dichloro-5-(1H-pyrrol-1-yl)phenoxy]acetate (CAS 338967-07-0) is a chemical compound with molecular formula C14H13Cl2NO3 and molecular weight 313.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(2,4-dichloro-5-pyrrol-1-ylphenoxy)acetate
Also Known As: ethyl 2-[2,4-dichloro-5-(1H-pyrrol-1-yl)phenoxy]acetate, 6L-345S, ethyl 2-(2,4-dichloro-5-pyrrol-1-ylphenoxy)acetate, Ethyl 2-(2,4-dichloro-5-pyrrol-1-yl-phenoxy)acetate, Ethyl [2,4-dichloro-5-(1H-pyrrol-1-yl)phenoxy]acetate
| Molecular Formula | C14H13Cl2NO3 |
|---|---|
| Molecular Weight | 313.03 g/mol |
| LogP | 3.726 |
| Topological Polar Surface Area | 40.46 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 313.02725 |
| Heavy Atoms | 20 |
| Complexity | 596.71655 |
Chemical Identifiers
| CAS Number | 338967-07-0 |
|---|---|
| SMILES | CCOC(=O)COC1=C(C=C(C(=C1)N2C=CC=C2)Cl)Cl |
Product Overview
ethyl 2-[2,4-dichloro-5-(1H-pyrrol-1-yl)phenoxy]acetate (CAS 338967-07-0), with molecular formula C14H13Cl2NO3 and molecular weight 313.03 g/mol. IUPAC: ethyl 2-(2,4-dichloro-5-pyrrol-1-ylphenoxy)acetate.
Chemical Property Profile of ethyl 2-[2,4-dichloro-5-(1H-pyrrol-1-yl)phenoxy]acetate
Property Insights of ethyl 2-[2,4-dichloro-5-(1H-pyrrol-1-yl)phenoxy]acetate
The XLogP value of 3.726 indicates that ethyl 2-[2,4-dichloro-5-(1H-pyrrol-1-yl)phenoxy]acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.46 Ų, ethyl 2-[2,4-dichloro-5-(1H-pyrrol-1-yl)phenoxy]acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ethyl 2-[2,4-dichloro-5-(1H-pyrrol-1-yl)phenoxy]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 ethyl 2-[2,4-dichloro-5-(1H-pyrrol-1-yl)phenoxy]acetate?
The CAS number of ethyl 2-[2,4-dichloro-5-(1H-pyrrol-1-yl)phenoxy]acetate is 338967-07-0.
What is the molecular formula of ethyl 2-[2,4-dichloro-5-(1H-pyrrol-1-yl)phenoxy]acetate?
The molecular formula of ethyl 2-[2,4-dichloro-5-(1H-pyrrol-1-yl)phenoxy]acetate is C14H13Cl2NO3.
What is the molecular weight of ethyl 2-[2,4-dichloro-5-(1H-pyrrol-1-yl)phenoxy]acetate?
The molecular weight of ethyl 2-[2,4-dichloro-5-(1H-pyrrol-1-yl)phenoxy]acetate is 313.03 g/mol.
Where can I buy ethyl 2-[2,4-dichloro-5-(1H-pyrrol-1-yl)phenoxy]acetate?
You can request a quote for ethyl 2-[2,4-dichloro-5-(1H-pyrrol-1-yl)phenoxy]acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 2-[2,4-dichloro-5-(1H-pyrrol-1-yl)phenoxy]acetate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 2-[2,4-dichloro-5-(1H-pyrrol-1-yl)phenoxy]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.