Methyl4,6-dichloronicotinate
TL;DR: Methyl4,6-dichloronicotinate (CAS 65973-52-6) is a chemical compound with molecular formula C7H5Cl2NO2 and molecular weight 204.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4,6-dichloropyridine-3-carboxylate
Also Known As: methyl 4,6-dichloronicotinate, methyl 4,6-dichloropyridine-3-carboxylate, Ester, Methyl4,6-dichloronicotinate, Bionet2_001679
| Molecular Formula | C7H5Cl2NO2 |
|---|---|
| Molecular Weight | 204.97 g/mol |
| LogP | 2.175 |
| Topological Polar Surface Area | 39.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 204.96973 |
| Heavy Atoms | 12 |
| Complexity | 314.27472 |
Chemical Identifiers
| CAS Number | 65973-52-6 |
|---|---|
| SMILES | COC(=O)C1=CN=C(C=C1Cl)Cl |
Product Overview
Methyl4,6-dichloronicotinate (CAS 65973-52-6), with molecular formula C7H5Cl2NO2 and molecular weight 204.97 g/mol. IUPAC: methyl 4,6-dichloropyridine-3-carboxylate.
Chemical Property Profile of Methyl4,6-dichloronicotinate
Property Insights of Methyl4,6-dichloronicotinate
The XLogP value of 2.175 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl4,6-dichloronicotinate. With a topological polar surface area (TPSA) of 39.19 Ų, Methyl4,6-dichloronicotinate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl4,6-dichloronicotinate 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 Methyl4,6-dichloronicotinate?
The CAS number of Methyl4,6-dichloronicotinate is 65973-52-6.
What is the molecular formula of Methyl4,6-dichloronicotinate?
The molecular formula of Methyl4,6-dichloronicotinate is C7H5Cl2NO2.
What is the molecular weight of Methyl4,6-dichloronicotinate?
The molecular weight of Methyl4,6-dichloronicotinate is 204.97 g/mol.
Where can I buy Methyl4,6-dichloronicotinate?
You can request a quote for Methyl4,6-dichloronicotinate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl4,6-dichloronicotinate?
Yes, KEHONG BIO provides custom synthesis services for Methyl4,6-dichloronicotinate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.