3,5-Dichloro-2,6-dimethyl-4-pyridinyl chloroacetate
TL;DR: 3,5-Dichloro-2,6-dimethyl-4-pyridinyl chloroacetate (CAS 40067-27-4) is a chemical compound with molecular formula C9H8Cl3NO2 and molecular weight 266.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3,5-dichloro-2,6-dimethyl-4-pyridinyl) 2-chloroacetate
Also Known As: 3,5-dichloro-4-chloroacetoxy-2,6-dimethyl-pyridine, 3,5-Dichloro-2,6-dimethyl-4-pyridinyl chloroacetate, 3,5-Dichloro-2,6-dimethyl-4-pyridinyl chloroacetate #, (3,5-dichloro-2,6-dimethylpyridin-4-yl) 2-chloroacetate, Axetic acid, chloro-, 3,5-dichloro-2,6-dimethyl-4-pyridyl ester
| Molecular Formula | C9H8Cl3NO2 |
|---|---|
| Molecular Weight | 266.96 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 39.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 266.96207 |
| Heavy Atoms | 15 |
| Complexity | 225.0 |
Chemical Identifiers
| CAS Number | 40067-27-4 |
|---|---|
| SMILES | CC1=C(C(=C(C(=N1)C)Cl)OC(=O)CCl)Cl |
| InChIKey | LURJTWLVASJRSU-UHFFFAOYSA-N |
Product Overview
3,5-Dichloro-2,6-dimethyl-4-pyridinyl chloroacetate (CAS 40067-27-4), with molecular formula C9H8Cl3NO2 and molecular weight 266.96 g/mol. IUPAC: (3,5-dichloro-2,6-dimethyl-4-pyridinyl) 2-chloroacetate.
Chemical Property Profile of 3,5-Dichloro-2,6-dimethyl-4-pyridinyl chloroacetate
Property Insights of 3,5-Dichloro-2,6-dimethyl-4-pyridinyl chloroacetate
The XLogP value of 3.3 indicates that 3,5-Dichloro-2,6-dimethyl-4-pyridinyl chloroacetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.2 Ų, 3,5-Dichloro-2,6-dimethyl-4-pyridinyl chloroacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,5-Dichloro-2,6-dimethyl-4-pyridinyl chloroacetate 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 3,5-Dichloro-2,6-dimethyl-4-pyridinyl chloroacetate?
The CAS number of 3,5-Dichloro-2,6-dimethyl-4-pyridinyl chloroacetate is 40067-27-4.
What is the molecular formula of 3,5-Dichloro-2,6-dimethyl-4-pyridinyl chloroacetate?
The molecular formula of 3,5-Dichloro-2,6-dimethyl-4-pyridinyl chloroacetate is C9H8Cl3NO2.
What is the molecular weight of 3,5-Dichloro-2,6-dimethyl-4-pyridinyl chloroacetate?
The molecular weight of 3,5-Dichloro-2,6-dimethyl-4-pyridinyl chloroacetate is 266.96 g/mol.
Where can I buy 3,5-Dichloro-2,6-dimethyl-4-pyridinyl chloroacetate?
You can request a quote for 3,5-Dichloro-2,6-dimethyl-4-pyridinyl chloroacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5-Dichloro-2,6-dimethyl-4-pyridinyl chloroacetate?
Yes, KEHONG BIO provides custom synthesis services for 3,5-Dichloro-2,6-dimethyl-4-pyridinyl chloroacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.