3,4,5,6-Tetrachloro-pyridine-2-carboxylic acid ethyl ester
TL;DR: 3,4,5,6-Tetrachloro-pyridine-2-carboxylic acid ethyl ester (CAS 32889-72-8) is a chemical compound with molecular formula C8H5Cl4NO2 and molecular weight 286.91 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3,4,5,6-tetrachloropyridine-2-carboxylate
Also Known As: ethyl 3,4,5,6-tetrachloropyridine-2-carboxylate, ethyl 3,4,5,6-tetrachloropicolinate, ethyl 3,4,5,6-tetrachloro-2-pyridinecarboxylate, 3,4,5,6-TETRACHLORO-PYRIDINE-2-CARBOXYLIC ACID ETHYL ESTER, 665-688-2
| Molecular Formula | C8H5Cl4NO2 |
|---|---|
| Molecular Weight | 286.91 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 39.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 286.90744 |
| Heavy Atoms | 15 |
| Complexity | 241.0 |
Chemical Identifiers
| CAS Number | 32889-72-8 |
|---|---|
| SMILES | CCOC(=O)C1=NC(=C(C(=C1Cl)Cl)Cl)Cl |
| InChIKey | HGEHWCJGGFGTFO-UHFFFAOYSA-N |
Product Overview
3,4,5,6-Tetrachloro-pyridine-2-carboxylic acid ethyl ester (CAS 32889-72-8), with molecular formula C8H5Cl4NO2 and molecular weight 286.91 g/mol. IUPAC: ethyl 3,4,5,6-tetrachloropyridine-2-carboxylate.
Chemical Property Profile of 3,4,5,6-Tetrachloro-pyridine-2-carboxylic acid ethyl ester
Property Insights of 3,4,5,6-Tetrachloro-pyridine-2-carboxylic acid ethyl ester
The XLogP value of 4.2 indicates that 3,4,5,6-Tetrachloro-pyridine-2-carboxylic acid ethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.2 Ų, 3,4,5,6-Tetrachloro-pyridine-2-carboxylic acid ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4,5,6-Tetrachloro-pyridine-2-carboxylic acid ethyl ester 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 3,4,5,6-Tetrachloro-pyridine-2-carboxylic acid ethyl ester?
The CAS number of 3,4,5,6-Tetrachloro-pyridine-2-carboxylic acid ethyl ester is 32889-72-8.
What is the molecular formula of 3,4,5,6-Tetrachloro-pyridine-2-carboxylic acid ethyl ester?
The molecular formula of 3,4,5,6-Tetrachloro-pyridine-2-carboxylic acid ethyl ester is C8H5Cl4NO2.
What is the molecular weight of 3,4,5,6-Tetrachloro-pyridine-2-carboxylic acid ethyl ester?
The molecular weight of 3,4,5,6-Tetrachloro-pyridine-2-carboxylic acid ethyl ester is 286.91 g/mol.
Where can I buy 3,4,5,6-Tetrachloro-pyridine-2-carboxylic acid ethyl ester?
You can request a quote for 3,4,5,6-Tetrachloro-pyridine-2-carboxylic acid ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4,5,6-Tetrachloro-pyridine-2-carboxylic acid ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for 3,4,5,6-Tetrachloro-pyridine-2-carboxylic acid ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.