![[2,3-Dichloro-4-(2-ethylidenebutyryl)phenoxy]acetic acid structure](/static/products/1431/1431-30-7.webp)
[2,3-Dichloro-4-(2-ethylidenebutyryl)phenoxy]acetic acid
TL;DR: [2,3-Dichloro-4-(2-ethylidenebutyryl)phenoxy]acetic acid (CAS 1431-30-7) is a chemical compound with molecular formula C14H14Cl2O4 and molecular weight 316.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2,3-dichloro-4-(2-ethylbut-2-enoyl)phenoxy]acetic acid
Also Known As: [2,3-Dichloro-4-(2-ethylidenebutyryl)phenoxy]acetic acid|orb1702125|PDQHXCCDRYPJFA-UHFFFAOYSA-N
| Molecular Formula | C14H14Cl2O4 |
|---|---|
| Molecular Weight | 316.03 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 316.02692 |
| Heavy Atoms | 20 |
| Complexity | 395.0 |
Chemical Identifiers
| CAS Number | 1431-30-7 |
|---|---|
| SMILES | CCC(=CC)C(=O)C1=C(C(=C(C=C1)OCC(=O)O)Cl)Cl |
| InChIKey | PDQHXCCDRYPJFA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
[2,3-Dichloro-4-(2-ethylidenebutyryl)phenoxy]acetic acid (CAS 1431-30-7), with molecular formula C14H14Cl2O4 and molecular weight 316.03 g/mol. IUPAC: 2-[2,3-dichloro-4-(2-ethylbut-2-enoyl)phenoxy]acetic acid.
Chemical Property Profile of [2,3-Dichloro-4-(2-ethylidenebutyryl)phenoxy]acetic acid
Property Insights of [2,3-Dichloro-4-(2-ethylidenebutyryl)phenoxy]acetic acid
The XLogP value of 4.1 indicates that [2,3-Dichloro-4-(2-ethylidenebutyryl)phenoxy]acetic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for [2,3-Dichloro-4-(2-ethylidenebutyryl)phenoxy]acetic acid. Following Lipinski's Rule of Five, [2,3-Dichloro-4-(2-ethylidenebutyryl)phenoxy]acetic acid has 1 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 [2,3-Dichloro-4-(2-ethylidenebutyryl)phenoxy]acetic acid?
The CAS number of [2,3-Dichloro-4-(2-ethylidenebutyryl)phenoxy]acetic acid is 1431-30-7.
What is the molecular formula of [2,3-Dichloro-4-(2-ethylidenebutyryl)phenoxy]acetic acid?
The molecular formula of [2,3-Dichloro-4-(2-ethylidenebutyryl)phenoxy]acetic acid is C14H14Cl2O4.
What is the molecular weight of [2,3-Dichloro-4-(2-ethylidenebutyryl)phenoxy]acetic acid?
The molecular weight of [2,3-Dichloro-4-(2-ethylidenebutyryl)phenoxy]acetic acid is 316.03 g/mol.
Where can I buy [2,3-Dichloro-4-(2-ethylidenebutyryl)phenoxy]acetic acid?
You can request a quote for [2,3-Dichloro-4-(2-ethylidenebutyryl)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 [2,3-Dichloro-4-(2-ethylidenebutyryl)phenoxy]acetic acid?
Yes, KEHONG BIO provides custom synthesis services for [2,3-Dichloro-4-(2-ethylidenebutyryl)phenoxy]acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.