Ammonium, benzyltrimethyl-, 2,4,5-trichlorophenoxyacetate
TL;DR: Ammonium, benzyltrimethyl-, 2,4,5-trichlorophenoxyacetate (CAS 73680-75-8) is a chemical compound with molecular formula C18H20Cl3NO3 and molecular weight 403.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl(trimethyl)azanium;2-(2,4,5-trichlorophenoxy)acetate
Also Known As: Benzyltrimethylammonium 2,4,5-trichlorophenoxyacetate, AMMONIUM, BENZYLTRIMETHYL-, 2,4,5-TRICHLOROPHENOXYACETATE, Ammonium, 2,4,5-(trichlorophenoxy)acetate, Ammonium, (benzyltrimethyl)-, 2,4,5-(trichlorophenoxy)acetate, Benzenemethanaminium, N,N,N-trimethyl-, salt with (2,4,5-trichlorophenoxy)acetic acid (1:1)
| Molecular Formula | C18H20Cl3NO3 |
|---|---|
| Molecular Weight | 403.05 g/mol |
| LogP | 3.67 |
| Topological Polar Surface Area | 49.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 403.05087 |
| Heavy Atoms | 25 |
| Complexity | 313.0 |
Chemical Identifiers
| CAS Number | 73680-75-8 |
|---|---|
| SMILES | C[N+](C)(C)CC1=CC=CC=C1.C1=C(C(=CC(=C1Cl)Cl)Cl)OCC(=O)[O-] |
| InChIKey | XZKDGCBIIUFIBP-UHFFFAOYSA-M |
Product Overview
Ammonium, benzyltrimethyl-, 2,4,5-trichlorophenoxyacetate (CAS 73680-75-8), with molecular formula C18H20Cl3NO3 and molecular weight 403.05 g/mol. IUPAC: benzyl(trimethyl)azanium;2-(2,4,5-trichlorophenoxy)acetate.
Chemical Property Profile of Ammonium, benzyltrimethyl-, 2,4,5-trichlorophenoxyacetate
Property Insights of Ammonium, benzyltrimethyl-, 2,4,5-trichlorophenoxyacetate
The XLogP value of 3.67 indicates that Ammonium, benzyltrimethyl-, 2,4,5-trichlorophenoxyacetate 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, benzyltrimethyl-, 2,4,5-trichlorophenoxyacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ammonium, benzyltrimethyl-, 2,4,5-trichlorophenoxyacetate 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, benzyltrimethyl-, 2,4,5-trichlorophenoxyacetate?
The CAS number of Ammonium, benzyltrimethyl-, 2,4,5-trichlorophenoxyacetate is 73680-75-8.
What is the molecular formula of Ammonium, benzyltrimethyl-, 2,4,5-trichlorophenoxyacetate?
The molecular formula of Ammonium, benzyltrimethyl-, 2,4,5-trichlorophenoxyacetate is C18H20Cl3NO3.
What is the molecular weight of Ammonium, benzyltrimethyl-, 2,4,5-trichlorophenoxyacetate?
The molecular weight of Ammonium, benzyltrimethyl-, 2,4,5-trichlorophenoxyacetate is 403.05 g/mol.
Where can I buy Ammonium, benzyltrimethyl-, 2,4,5-trichlorophenoxyacetate?
You can request a quote for Ammonium, benzyltrimethyl-, 2,4,5-trichlorophenoxyacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ammonium, benzyltrimethyl-, 2,4,5-trichlorophenoxyacetate?
Yes, KEHONG BIO provides custom synthesis services for Ammonium, benzyltrimethyl-, 2,4,5-trichlorophenoxyacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.