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Methyl 5-[(4-cyanophenoxy)methyl]-2-furoate
TL;DR: Methyl 5-[(4-cyanophenoxy)methyl]-2-furoate (CAS 406470-75-5) is a chemical compound with molecular formula C14H11NO4 and molecular weight 257.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-[(4-cyanophenoxy)methyl]furan-2-carboxylate
Also Known As: methyl 5-[(4-cyanophenoxy)methyl]-2-furoate, ChemDiv2_001760, methyl 5-[(4-cyanophenoxy)methyl]furan-2-carboxylate, BAS 06332532, Methyl 5-((4-cyanophenoxy)methyl)furan-2-carboxylate
| Molecular Formula | C14H11NO4 |
|---|---|
| Molecular Weight | 257.07 g/mol |
| LogP | 2.51688 |
| Topological Polar Surface Area | 72.46 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 257.06882 |
| Heavy Atoms | 19 |
| Complexity | 607.12134 |
Chemical Identifiers
| CAS Number | 406470-75-5 |
|---|---|
| SMILES | COC(=O)C1=CC=C(O1)COC2=CC=C(C=C2)C#N |
Product Overview
Methyl 5-[(4-cyanophenoxy)methyl]-2-furoate (CAS 406470-75-5), with molecular formula C14H11NO4 and molecular weight 257.07 g/mol. IUPAC: methyl 5-[(4-cyanophenoxy)methyl]furan-2-carboxylate.
Chemical Property Profile of Methyl 5-[(4-cyanophenoxy)methyl]-2-furoate
Property Insights of Methyl 5-[(4-cyanophenoxy)methyl]-2-furoate
The XLogP value of 2.51688 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 5-[(4-cyanophenoxy)methyl]-2-furoate. The TPSA of 72.46 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 5-[(4-cyanophenoxy)methyl]-2-furoate. Following Lipinski's Rule of Five, Methyl 5-[(4-cyanophenoxy)methyl]-2-furoate 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 Methyl 5-[(4-cyanophenoxy)methyl]-2-furoate?
The CAS number of Methyl 5-[(4-cyanophenoxy)methyl]-2-furoate is 406470-75-5.
What is the molecular formula of Methyl 5-[(4-cyanophenoxy)methyl]-2-furoate?
The molecular formula of Methyl 5-[(4-cyanophenoxy)methyl]-2-furoate is C14H11NO4.
What is the molecular weight of Methyl 5-[(4-cyanophenoxy)methyl]-2-furoate?
The molecular weight of Methyl 5-[(4-cyanophenoxy)methyl]-2-furoate is 257.07 g/mol.
Where can I buy Methyl 5-[(4-cyanophenoxy)methyl]-2-furoate?
You can request a quote for Methyl 5-[(4-cyanophenoxy)methyl]-2-furoate 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-cyanophenoxy)methyl]-2-furoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 5-[(4-cyanophenoxy)methyl]-2-furoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.