Methyl 2-chloro-3-oxo-3-(p-methoxyphenyl)propionate
TL;DR: Methyl 2-chloro-3-oxo-3-(p-methoxyphenyl)propionate (CAS 78437-40-8) is a chemical compound with molecular formula C11H11ClO4 and molecular weight 242.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-chloro-3-(4-methoxyphenyl)-3-oxopropanoate
Also Known As: methyl 2-chloro-3-(4-methoxyphenyl)-3-oxopropionate, Methyl 2-chloro-3-(4-methoxyphenyl)-3-oxo-propanoate, methyl 2-chloro-3-(4-methoxyphenyl)-3-oxopropanoate, methyl 2-chloro-3-oxo-3-(p-methoxyphenyl)propionate, 2-Chloro-3-(4-methoxyphenyl)-3-oxopropionic acid methyl ester
| Molecular Formula | C11H11ClO4 |
|---|---|
| Molecular Weight | 242.03 g/mol |
| LogP | 1.6583 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 242.03459 |
| Heavy Atoms | 16 |
| Complexity | 385.47595 |
Chemical Identifiers
| CAS Number | 78437-40-8 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C(=O)C(C(=O)OC)Cl |
Product Overview
Methyl 2-chloro-3-oxo-3-(p-methoxyphenyl)propionate (CAS 78437-40-8), with molecular formula C11H11ClO4 and molecular weight 242.03 g/mol. IUPAC: methyl 2-chloro-3-(4-methoxyphenyl)-3-oxopropanoate.
Chemical Property Profile of Methyl 2-chloro-3-oxo-3-(p-methoxyphenyl)propionate
Property Insights of Methyl 2-chloro-3-oxo-3-(p-methoxyphenyl)propionate
The XLogP value of 1.6583 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-chloro-3-oxo-3-(p-methoxyphenyl)propionate. With a topological polar surface area (TPSA) of 52.6 Ų, Methyl 2-chloro-3-oxo-3-(p-methoxyphenyl)propionate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 2-chloro-3-oxo-3-(p-methoxyphenyl)propionate has 0 hydrogen bond donor(s) and 4 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-chloro-3-oxo-3-(p-methoxyphenyl)propionate?
The CAS number of Methyl 2-chloro-3-oxo-3-(p-methoxyphenyl)propionate is 78437-40-8.
What is the molecular formula of Methyl 2-chloro-3-oxo-3-(p-methoxyphenyl)propionate?
The molecular formula of Methyl 2-chloro-3-oxo-3-(p-methoxyphenyl)propionate is C11H11ClO4.
What is the molecular weight of Methyl 2-chloro-3-oxo-3-(p-methoxyphenyl)propionate?
The molecular weight of Methyl 2-chloro-3-oxo-3-(p-methoxyphenyl)propionate is 242.03 g/mol.
Where can I buy Methyl 2-chloro-3-oxo-3-(p-methoxyphenyl)propionate?
You can request a quote for Methyl 2-chloro-3-oxo-3-(p-methoxyphenyl)propionate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-chloro-3-oxo-3-(p-methoxyphenyl)propionate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-chloro-3-oxo-3-(p-methoxyphenyl)propionate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.