Ammonium, benzyltriethyl-, 2,4-dichlorophenoxyacetate
TL;DR: Ammonium, benzyltriethyl-, 2,4-dichlorophenoxyacetate (CAS 73680-68-9) is a chemical compound with molecular formula C21H27Cl2NO3 and molecular weight 411.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl(triethyl)azanium;2-(2,4-dichlorophenoxy)acetate
Also Known As: Benzyltriethylammonium 2,4-dichlorophenoxyacetate, Ammonium, 2,4-(dichlorophenoxy)acetate, AMMONIUM, BENZYLTRIETHYL-, 2,4-DICHLOROPHENOXYACETATE, Ammonium, (benzyltriethyl)-, 2,4-(dichlorophenoxy)acetate, (Benzyltriethyl)ammonium 2,4-(dichlorophenoxy)acetate
| Molecular Formula | C21H27Cl2NO3 |
|---|---|
| Molecular Weight | 411.14 g/mol |
| LogP | 4.19 |
| Topological Polar Surface Area | 49.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 411.1368 |
| Heavy Atoms | 27 |
| Complexity | 316.0 |
Chemical Identifiers
| CAS Number | 73680-68-9 |
|---|---|
| SMILES | CC[N+](CC)(CC)CC1=CC=CC=C1.C1=CC(=C(C=C1Cl)Cl)OCC(=O)[O-] |
| InChIKey | TYDHYKNWUCSXFK-UHFFFAOYSA-M |
Product Overview
Ammonium, benzyltriethyl-, 2,4-dichlorophenoxyacetate (CAS 73680-68-9), with molecular formula C21H27Cl2NO3 and molecular weight 411.14 g/mol. IUPAC: benzyl(triethyl)azanium;2-(2,4-dichlorophenoxy)acetate.
Chemical Property Profile of Ammonium, benzyltriethyl-, 2,4-dichlorophenoxyacetate
Property Insights of Ammonium, benzyltriethyl-, 2,4-dichlorophenoxyacetate
The XLogP value of 4.19 indicates that Ammonium, benzyltriethyl-, 2,4-dichlorophenoxyacetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.4 Ų, Ammonium, benzyltriethyl-, 2,4-dichlorophenoxyacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ammonium, benzyltriethyl-, 2,4-dichlorophenoxyacetate 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 Ammonium, benzyltriethyl-, 2,4-dichlorophenoxyacetate?
The CAS number of Ammonium, benzyltriethyl-, 2,4-dichlorophenoxyacetate is 73680-68-9.
What is the molecular formula of Ammonium, benzyltriethyl-, 2,4-dichlorophenoxyacetate?
The molecular formula of Ammonium, benzyltriethyl-, 2,4-dichlorophenoxyacetate is C21H27Cl2NO3.
What is the molecular weight of Ammonium, benzyltriethyl-, 2,4-dichlorophenoxyacetate?
The molecular weight of Ammonium, benzyltriethyl-, 2,4-dichlorophenoxyacetate is 411.14 g/mol.
Where can I buy Ammonium, benzyltriethyl-, 2,4-dichlorophenoxyacetate?
You can request a quote for Ammonium, benzyltriethyl-, 2,4-dichlorophenoxyacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ammonium, benzyltriethyl-, 2,4-dichlorophenoxyacetate?
Yes, KEHONG BIO provides custom synthesis services for Ammonium, benzyltriethyl-, 2,4-dichlorophenoxyacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.