Methyl 2-chloro-3-(4-chloro-3-nitrophenyl)propanoate
TL;DR: Methyl 2-chloro-3-(4-chloro-3-nitrophenyl)propanoate (CAS 30565-73-2) is a chemical compound with molecular formula C10H9Cl2NO4 and molecular weight 276.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-chloro-3-(4-chloro-3-nitrophenyl)propanoate
Also Known As: methyl alpha,4-dichloro-3-nitrohydrocinnamate, methyl 2-chloro-3-(4-chloro-3-nitrophenyl)propanoate, Methyl 2-chloro-3-(4-chloro-3-nitro-phenyl)propanoate
| Molecular Formula | C10H9Cl2NO4 |
|---|---|
| Molecular Weight | 276.99 g/mol |
| LogP | 2.5711 |
| Topological Polar Surface Area | 69.44 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 276.99088 |
| Heavy Atoms | 17 |
| Complexity | 449.93207 |
Chemical Identifiers
| CAS Number | 30565-73-2 |
|---|---|
| SMILES | COC(=O)C(CC1=CC(=C(C=C1)Cl)[N+](=O)[O-])Cl |
Product Overview
Methyl 2-chloro-3-(4-chloro-3-nitrophenyl)propanoate (CAS 30565-73-2), with molecular formula C10H9Cl2NO4 and molecular weight 276.99 g/mol. IUPAC: methyl 2-chloro-3-(4-chloro-3-nitrophenyl)propanoate.
Chemical Property Profile of Methyl 2-chloro-3-(4-chloro-3-nitrophenyl)propanoate
Property Insights of Methyl 2-chloro-3-(4-chloro-3-nitrophenyl)propanoate
The XLogP value of 2.5711 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-chloro-3-(4-chloro-3-nitrophenyl)propanoate. The TPSA of 69.44 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-chloro-3-(4-chloro-3-nitrophenyl)propanoate. Following Lipinski's Rule of Five, Methyl 2-chloro-3-(4-chloro-3-nitrophenyl)propanoate 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-(4-chloro-3-nitrophenyl)propanoate?
The CAS number of Methyl 2-chloro-3-(4-chloro-3-nitrophenyl)propanoate is 30565-73-2.
What is the molecular formula of Methyl 2-chloro-3-(4-chloro-3-nitrophenyl)propanoate?
The molecular formula of Methyl 2-chloro-3-(4-chloro-3-nitrophenyl)propanoate is C10H9Cl2NO4.
What is the molecular weight of Methyl 2-chloro-3-(4-chloro-3-nitrophenyl)propanoate?
The molecular weight of Methyl 2-chloro-3-(4-chloro-3-nitrophenyl)propanoate is 276.99 g/mol.
Where can I buy Methyl 2-chloro-3-(4-chloro-3-nitrophenyl)propanoate?
You can request a quote for Methyl 2-chloro-3-(4-chloro-3-nitrophenyl)propanoate 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-(4-chloro-3-nitrophenyl)propanoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-chloro-3-(4-chloro-3-nitrophenyl)propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.