Methyl 2,2,3,3-tetrachloropropanoate
TL;DR: Methyl 2,2,3,3-tetrachloropropanoate (CAS 20618-05-7) is a chemical compound with molecular formula C4H4Cl4O2 and molecular weight 223.90 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2,2,3,3-tetrachloropropanoate
Also Known As: Methyl 2,2,3,3-tetrachloropropanoate, Methyl 2.2.3.3-tetrachloropropanoate, Methyl 2,2,3,3-tetrachloropropanoate #, Propanoic acid, 2,2,3,3-tetrachloro-, methyl ester, 2,2,3,3-Tetrachloropropanoic acid methyl ester
| Molecular Formula | C4H4Cl4O2 |
|---|---|
| Molecular Weight | 223.90 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 223.89655 |
| Heavy Atoms | 10 |
| Complexity | 133.0 |
Chemical Identifiers
| CAS Number | 20618-05-7 |
|---|---|
| SMILES | COC(=O)C(C(Cl)Cl)(Cl)Cl |
| InChIKey | UQYYMXYJSOOLLA-UHFFFAOYSA-N |
Product Overview
Methyl 2,2,3,3-tetrachloropropanoate (CAS 20618-05-7), with molecular formula C4H4Cl4O2 and molecular weight 223.90 g/mol. IUPAC: methyl 2,2,3,3-tetrachloropropanoate.
Chemical Property Profile of Methyl 2,2,3,3-tetrachloropropanoate
Property Insights of Methyl 2,2,3,3-tetrachloropropanoate
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2,2,3,3-tetrachloropropanoate. With a topological polar surface area (TPSA) of 26.3 Ų, Methyl 2,2,3,3-tetrachloropropanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 2,2,3,3-tetrachloropropanoate has 0 hydrogen bond donor(s) and 2 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 Methyl 2,2,3,3-tetrachloropropanoate?
The CAS number of Methyl 2,2,3,3-tetrachloropropanoate is 20618-05-7.
What is the molecular formula of Methyl 2,2,3,3-tetrachloropropanoate?
The molecular formula of Methyl 2,2,3,3-tetrachloropropanoate is C4H4Cl4O2.
What is the molecular weight of Methyl 2,2,3,3-tetrachloropropanoate?
The molecular weight of Methyl 2,2,3,3-tetrachloropropanoate is 223.90 g/mol.
Where can I buy Methyl 2,2,3,3-tetrachloropropanoate?
You can request a quote for Methyl 2,2,3,3-tetrachloropropanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2,2,3,3-tetrachloropropanoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2,2,3,3-tetrachloropropanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.