4-(Methoxycarbonyl)phenyl 4-(2,4-dichlorophenoxy)butanoate
TL;DR: 4-(Methoxycarbonyl)phenyl 4-(2,4-dichlorophenoxy)butanoate (CAS 415695-40-8) is a chemical compound with molecular formula C18H16Cl2O5 and molecular weight 382.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[4-(2,4-dichlorophenoxy)butanoyloxy]benzoate
Also Known As: methyl 4-[4-(2,4-dichlorophenoxy)butanoyloxy]benzoate, 4-(methoxycarbonyl)phenyl 4-(2,4-dichlorophenoxy)butanoate, methyl 4-((4-(2,4-dichlorophenoxy)butanoyl)oxy)benzoate, methyl 4-{[4-(2,4-dichlorophenoxy)butanoyl]oxy}benzoate
| Molecular Formula | C18H16Cl2O5 |
|---|---|
| Molecular Weight | 382.04 g/mol |
| LogP | 4.5446 |
| Topological Polar Surface Area | 61.83 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 382.03748 |
| Heavy Atoms | 25 |
| Complexity | 743.6317 |
Chemical Identifiers
| CAS Number | 415695-40-8 |
|---|---|
| SMILES | COC(=O)C1=CC=C(C=C1)OC(=O)CCCOC2=C(C=C(C=C2)Cl)Cl |
Product Overview
4-(Methoxycarbonyl)phenyl 4-(2,4-dichlorophenoxy)butanoate (CAS 415695-40-8), with molecular formula C18H16Cl2O5 and molecular weight 382.04 g/mol. IUPAC: methyl 4-[4-(2,4-dichlorophenoxy)butanoyloxy]benzoate.
Chemical Property Profile of 4-(Methoxycarbonyl)phenyl 4-(2,4-dichlorophenoxy)butanoate
Property Insights of 4-(Methoxycarbonyl)phenyl 4-(2,4-dichlorophenoxy)butanoate
The XLogP value of 4.5446 indicates that 4-(Methoxycarbonyl)phenyl 4-(2,4-dichlorophenoxy)butanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.83 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(Methoxycarbonyl)phenyl 4-(2,4-dichlorophenoxy)butanoate. Following Lipinski's Rule of Five, 4-(Methoxycarbonyl)phenyl 4-(2,4-dichlorophenoxy)butanoate has 0 hydrogen bond donor(s) and 5 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 4-(Methoxycarbonyl)phenyl 4-(2,4-dichlorophenoxy)butanoate?
The CAS number of 4-(Methoxycarbonyl)phenyl 4-(2,4-dichlorophenoxy)butanoate is 415695-40-8.
What is the molecular formula of 4-(Methoxycarbonyl)phenyl 4-(2,4-dichlorophenoxy)butanoate?
The molecular formula of 4-(Methoxycarbonyl)phenyl 4-(2,4-dichlorophenoxy)butanoate is C18H16Cl2O5.
What is the molecular weight of 4-(Methoxycarbonyl)phenyl 4-(2,4-dichlorophenoxy)butanoate?
The molecular weight of 4-(Methoxycarbonyl)phenyl 4-(2,4-dichlorophenoxy)butanoate is 382.04 g/mol.
Where can I buy 4-(Methoxycarbonyl)phenyl 4-(2,4-dichlorophenoxy)butanoate?
You can request a quote for 4-(Methoxycarbonyl)phenyl 4-(2,4-dichlorophenoxy)butanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(Methoxycarbonyl)phenyl 4-(2,4-dichlorophenoxy)butanoate?
Yes, KEHONG BIO provides custom synthesis services for 4-(Methoxycarbonyl)phenyl 4-(2,4-dichlorophenoxy)butanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.