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Methyl 3-[(2,4-dichlorophenyl)methoxy]benzoate
TL;DR: Methyl 3-[(2,4-dichlorophenyl)methoxy]benzoate (CAS 58045-41-3) is a chemical compound with molecular formula C15H12Cl2O3 and molecular weight 310.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-[(2,4-dichlorophenyl)methoxy]benzoate
Also Known As: methyl 3-[(2,4-dichlorophenyl)methoxy]benzoate, 1H-Indazole-3-Carbaldehyde, Methyl 3-((2,4-dichlorobenzyl)oxy)benzoate, methyl 3-[(2,4-dichlorobenzyl)oxy]benzenecarboxylate, Methyl 3-[(2,4-dichlorobenzyl)oxy]-benzenecarboxylate
| Molecular Formula | C15H12Cl2O3 |
|---|---|
| Molecular Weight | 310.02 g/mol |
| LogP | 4.359 |
| Topological Polar Surface Area | 35.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 310.01636 |
| Heavy Atoms | 20 |
| Complexity | 626.26575 |
Chemical Identifiers
| CAS Number | 58045-41-3 |
|---|---|
| SMILES | COC(=O)C1=CC(=CC=C1)OCC2=C(C=C(C=C2)Cl)Cl |
Product Overview
Methyl 3-[(2,4-dichlorophenyl)methoxy]benzoate (CAS 58045-41-3), with molecular formula C15H12Cl2O3 and molecular weight 310.02 g/mol. IUPAC: methyl 3-[(2,4-dichlorophenyl)methoxy]benzoate.
Chemical Property Profile of Methyl 3-[(2,4-dichlorophenyl)methoxy]benzoate
Property Insights of Methyl 3-[(2,4-dichlorophenyl)methoxy]benzoate
The XLogP value of 4.359 indicates that Methyl 3-[(2,4-dichlorophenyl)methoxy]benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.53 Ų, Methyl 3-[(2,4-dichlorophenyl)methoxy]benzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 3-[(2,4-dichlorophenyl)methoxy]benzoate 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 Methyl 3-[(2,4-dichlorophenyl)methoxy]benzoate?
The CAS number of Methyl 3-[(2,4-dichlorophenyl)methoxy]benzoate is 58045-41-3.
What is the molecular formula of Methyl 3-[(2,4-dichlorophenyl)methoxy]benzoate?
The molecular formula of Methyl 3-[(2,4-dichlorophenyl)methoxy]benzoate is C15H12Cl2O3.
What is the molecular weight of Methyl 3-[(2,4-dichlorophenyl)methoxy]benzoate?
The molecular weight of Methyl 3-[(2,4-dichlorophenyl)methoxy]benzoate is 310.02 g/mol.
Where can I buy Methyl 3-[(2,4-dichlorophenyl)methoxy]benzoate?
You can request a quote for Methyl 3-[(2,4-dichlorophenyl)methoxy]benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 3-[(2,4-dichlorophenyl)methoxy]benzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3-[(2,4-dichlorophenyl)methoxy]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.