Diethylammonium 2-(4-chloro-2-methylphenoxy)propionate
TL;DR: Diethylammonium 2-(4-chloro-2-methylphenoxy)propionate (CAS 56913-43-0) is a chemical compound with molecular formula C14H22ClNO3 and molecular weight 287.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-chloro-2-methylphenoxy)propanoic acid;N-ethylethanamine
Also Known As: Mecopar, Mecoprop diethylamine, mecoprop-diethylammonium, EINECS 260-428-0, EINECS 306-402-5
| Molecular Formula | C14H22ClNO3 |
|---|---|
| Molecular Weight | 287.13 g/mol |
| LogP | 3.11612 |
| Topological Polar Surface Area | 58.56 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 287.1288 |
| Heavy Atoms | 19 |
| Complexity | 394.2775 |
Chemical Identifiers
| CAS Number | 56913-43-0 |
|---|---|
| SMILES | CCNCC.CC1=C(C=CC(=C1)Cl)OC(C)C(=O)O |
Product Overview
Diethylammonium 2-(4-chloro-2-methylphenoxy)propionate (CAS 56913-43-0), with molecular formula C14H22ClNO3 and molecular weight 287.13 g/mol. IUPAC: 2-(4-chloro-2-methylphenoxy)propanoic acid;N-ethylethanamine.
Chemical Property Profile of Diethylammonium 2-(4-chloro-2-methylphenoxy)propionate
Property Insights of Diethylammonium 2-(4-chloro-2-methylphenoxy)propionate
The XLogP value of 3.11612 indicates that Diethylammonium 2-(4-chloro-2-methylphenoxy)propionate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.56 Ų, Diethylammonium 2-(4-chloro-2-methylphenoxy)propionate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Diethylammonium 2-(4-chloro-2-methylphenoxy)propionate has 2 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 Diethylammonium 2-(4-chloro-2-methylphenoxy)propionate?
The CAS number of Diethylammonium 2-(4-chloro-2-methylphenoxy)propionate is 56913-43-0.
What is the molecular formula of Diethylammonium 2-(4-chloro-2-methylphenoxy)propionate?
The molecular formula of Diethylammonium 2-(4-chloro-2-methylphenoxy)propionate is C14H22ClNO3.
What is the molecular weight of Diethylammonium 2-(4-chloro-2-methylphenoxy)propionate?
The molecular weight of Diethylammonium 2-(4-chloro-2-methylphenoxy)propionate is 287.13 g/mol.
Where can I buy Diethylammonium 2-(4-chloro-2-methylphenoxy)propionate?
You can request a quote for Diethylammonium 2-(4-chloro-2-methylphenoxy)propionate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethylammonium 2-(4-chloro-2-methylphenoxy)propionate?
Yes, KEHONG BIO provides custom synthesis services for Diethylammonium 2-(4-chloro-2-methylphenoxy)propionate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.