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Methyl 5-[(4-chloro-3-methylphenoxy)methyl]furan-2-carboxylate
TL;DR: Methyl 5-[(4-chloro-3-methylphenoxy)methyl]furan-2-carboxylate (CAS 406470-76-6) is a chemical compound with molecular formula C14H13ClO4 and molecular weight 280.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-[(4-chloro-3-methylphenoxy)methyl]furan-2-carboxylate
Also Known As: methyl 5-[(4-chloro-3-methylphenoxy)methyl]furan-2-carboxylate, methyl 5-[(4-chloro-3-methylphenoxy)methyl]-2-furoate, methyl 5-((4-chloro-3-methylphenoxy)methyl)furan-2-carboxylate
| Molecular Formula | C14H13ClO4 |
|---|---|
| Molecular Weight | 280.05 g/mol |
| LogP | 3.60702 |
| Topological Polar Surface Area | 48.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 280.05023 |
| Heavy Atoms | 19 |
| Complexity | 588.88196 |
Chemical Identifiers
| CAS Number | 406470-76-6 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)OCC2=CC=C(O2)C(=O)OC)Cl |
Product Overview
Methyl 5-[(4-chloro-3-methylphenoxy)methyl]furan-2-carboxylate (CAS 406470-76-6), with molecular formula C14H13ClO4 and molecular weight 280.05 g/mol. IUPAC: methyl 5-[(4-chloro-3-methylphenoxy)methyl]furan-2-carboxylate.
Chemical Property Profile of Methyl 5-[(4-chloro-3-methylphenoxy)methyl]furan-2-carboxylate
Property Insights of Methyl 5-[(4-chloro-3-methylphenoxy)methyl]furan-2-carboxylate
The XLogP value of 3.60702 indicates that Methyl 5-[(4-chloro-3-methylphenoxy)methyl]furan-2-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.67 Ų, Methyl 5-[(4-chloro-3-methylphenoxy)methyl]furan-2-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 5-[(4-chloro-3-methylphenoxy)methyl]furan-2-carboxylate 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 5-[(4-chloro-3-methylphenoxy)methyl]furan-2-carboxylate?
The CAS number of Methyl 5-[(4-chloro-3-methylphenoxy)methyl]furan-2-carboxylate is 406470-76-6.
What is the molecular formula of Methyl 5-[(4-chloro-3-methylphenoxy)methyl]furan-2-carboxylate?
The molecular formula of Methyl 5-[(4-chloro-3-methylphenoxy)methyl]furan-2-carboxylate is C14H13ClO4.
What is the molecular weight of Methyl 5-[(4-chloro-3-methylphenoxy)methyl]furan-2-carboxylate?
The molecular weight of Methyl 5-[(4-chloro-3-methylphenoxy)methyl]furan-2-carboxylate is 280.05 g/mol.
Where can I buy Methyl 5-[(4-chloro-3-methylphenoxy)methyl]furan-2-carboxylate?
You can request a quote for Methyl 5-[(4-chloro-3-methylphenoxy)methyl]furan-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 5-[(4-chloro-3-methylphenoxy)methyl]furan-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 5-[(4-chloro-3-methylphenoxy)methyl]furan-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.