Triclopyr-butotyl
TL;DR: Triclopyr-butotyl (CAS 64700-56-7) is a chemical compound with molecular formula C13H16Cl3NO4 and molecular weight 355.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-butoxyethyl 2-[(3,5,6-trichloro-2-pyridinyl)oxy]acetate
Also Known As: Triclopyr-butotyl, Triclopyr butotyl, Garlon 4, Garlon 4E, Triclopyr butoxyethyl ester
| Molecular Formula | C13H16Cl3NO4 |
|---|---|
| Molecular Weight | 355.01 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 57.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 355.0145 |
| Heavy Atoms | 21 |
| Complexity | 309.0 |
| Boiling Point | 370 °C |
| Density | Relative density (water = 1): 1.3 |
| Solubility | Solubility in water: none |
| Vapor Pressure | 0.00000079 [mmHg] |
Chemical Identifiers
| CAS Number | 64700-56-7 |
|---|---|
| SMILES | CCCCOCCOC(=O)COC1=NC(=C(C=C1Cl)Cl)Cl |
| InChIKey | IVDRCZNHVGQBHZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Triclopyr-butotyl (CAS 64700-56-7), with molecular formula C13H16Cl3NO4 and molecular weight 355.01 g/mol. IUPAC: 2-butoxyethyl 2-[(3,5,6-trichloro-2-pyridinyl)oxy]acetate.
Chemical Property Profile of Triclopyr-butotyl
Property Insights of Triclopyr-butotyl
The XLogP value of 4.4 indicates that Triclopyr-butotyl is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.7 Ų, Triclopyr-butotyl exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Triclopyr-butotyl has 0 hydrogen bond donor(s) and 5 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 Triclopyr-butotyl?
The CAS number of Triclopyr-butotyl is 64700-56-7.
What is the molecular formula of Triclopyr-butotyl?
The molecular formula of Triclopyr-butotyl is C13H16Cl3NO4.
What is the molecular weight of Triclopyr-butotyl?
The molecular weight of Triclopyr-butotyl is 355.01 g/mol.
Where can I buy Triclopyr-butotyl?
You can request a quote for Triclopyr-butotyl directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Triclopyr-butotyl?
Yes, KEHONG BIO provides custom synthesis services for Triclopyr-butotyl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.