![[4-Chloro-2-(chloromethyl)phenoxy]acetic acid structure](/static/products/5424/54246-67-2.webp)
[4-Chloro-2-(chloromethyl)phenoxy]acetic acid
TL;DR: [4-Chloro-2-(chloromethyl)phenoxy]acetic acid (CAS 54246-67-2) is a chemical compound with molecular formula C9H8Cl2O3 and molecular weight 233.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-chloro-2-(chloromethyl)phenoxy]acetic acid
Also Known As: [4-chloro-2-(chloromethyl)phenoxy]acetic acid|Butane,1,4-dinitro|2-[4-chloro-2-(chloromethyl)phenoxy]acetic acid|CHEMBRDG-BB7119439|CHEMBRDG-BB 7119439|2-(4-Chloro-2-(chloromethyl)phenoxy)acetic acid|4-chloro-2-chloromethyl-phenoxyacetic acid|acetic acid, 2-[4-chloro-2-(chloromethyl)phenoxy]-|[4-Chloro-2-(chloromethyl)phenoxy]aceticacid|4-CHLORO-2-(CHLOROMETHYL)PHENOXYACETIC ACID|acetic acid, [4-chloro-2-(chloromethyl)phenoxy]-|(4-Chloro-2-chloromethyl-phenoxy)-acetic acid|2-(4-Chloro-2-(chloromethyl)phenoxy)aceticacid|A2545/0108323|MFCD02625861|YEMQCPPILNZOCE-UHFFFAOYSA-N|ALBB-025550
| Molecular Formula | C9H8Cl2O3 |
|---|---|
| Molecular Weight | 233.99 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 233.98505 |
| Heavy Atoms | 14 |
| Complexity | 198.0 |
Chemical Identifiers
| CAS Number | 54246-67-2 |
|---|---|
| SMILES | C1=CC(=C(C=C1Cl)CCl)OCC(=O)O |
| InChIKey | YEMQCPPILNZOCE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
[4-Chloro-2-(chloromethyl)phenoxy]acetic acid (CAS 54246-67-2), with molecular formula C9H8Cl2O3 and molecular weight 233.99 g/mol. IUPAC: 2-[4-chloro-2-(chloromethyl)phenoxy]acetic acid.
Chemical Property Profile of [4-Chloro-2-(chloromethyl)phenoxy]acetic acid
Property Insights of [4-Chloro-2-(chloromethyl)phenoxy]acetic acid
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [4-Chloro-2-(chloromethyl)phenoxy]acetic acid. With a topological polar surface area (TPSA) of 46.5 Ų, [4-Chloro-2-(chloromethyl)phenoxy]acetic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [4-Chloro-2-(chloromethyl)phenoxy]acetic acid has 1 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 [4-Chloro-2-(chloromethyl)phenoxy]acetic acid?
The CAS number of [4-Chloro-2-(chloromethyl)phenoxy]acetic acid is 54246-67-2.
What is the molecular formula of [4-Chloro-2-(chloromethyl)phenoxy]acetic acid?
The molecular formula of [4-Chloro-2-(chloromethyl)phenoxy]acetic acid is C9H8Cl2O3.
What is the molecular weight of [4-Chloro-2-(chloromethyl)phenoxy]acetic acid?
The molecular weight of [4-Chloro-2-(chloromethyl)phenoxy]acetic acid is 233.99 g/mol.
Where can I buy [4-Chloro-2-(chloromethyl)phenoxy]acetic acid?
You can request a quote for [4-Chloro-2-(chloromethyl)phenoxy]acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [4-Chloro-2-(chloromethyl)phenoxy]acetic acid?
Yes, KEHONG BIO provides custom synthesis services for [4-Chloro-2-(chloromethyl)phenoxy]acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.