Furan-2-ylmethyl 4-chlorobenzoate
TL;DR: Furan-2-ylmethyl 4-chlorobenzoate (CAS 4449-28-9) is a chemical compound with molecular formula C12H9ClO3 and molecular weight 236.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
furan-2-ylmethyl 4-chlorobenzoate
Also Known As: furan-2-ylmethyl 4-chlorobenzoate, Trifluridine Impurity 4, 2-furylmethyl 4-chlorobenzoate, Trifluridine Impurity 11, 2-(4-chloro-benzoyloxymethyl)-furan
| Molecular Formula | C12H9ClO3 |
|---|---|
| Molecular Weight | 236.02 g/mol |
| LogP | 3.29 |
| Topological Polar Surface Area | 39.44 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 236.02402 |
| Heavy Atoms | 16 |
| Complexity | 459.51892 |
Chemical Identifiers
| CAS Number | 4449-28-9 |
|---|---|
| SMILES | C1=COC(=C1)COC(=O)C2=CC=C(C=C2)Cl |
Product Overview
Furan-2-ylmethyl 4-chlorobenzoate (CAS 4449-28-9), with molecular formula C12H9ClO3 and molecular weight 236.02 g/mol. IUPAC: furan-2-ylmethyl 4-chlorobenzoate.
Chemical Property Profile of Furan-2-ylmethyl 4-chlorobenzoate
Property Insights of Furan-2-ylmethyl 4-chlorobenzoate
The XLogP value of 3.29 indicates that Furan-2-ylmethyl 4-chlorobenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.44 Ų, Furan-2-ylmethyl 4-chlorobenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Furan-2-ylmethyl 4-chlorobenzoate 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 Furan-2-ylmethyl 4-chlorobenzoate?
The CAS number of Furan-2-ylmethyl 4-chlorobenzoate is 4449-28-9.
What is the molecular formula of Furan-2-ylmethyl 4-chlorobenzoate?
The molecular formula of Furan-2-ylmethyl 4-chlorobenzoate is C12H9ClO3.
What is the molecular weight of Furan-2-ylmethyl 4-chlorobenzoate?
The molecular weight of Furan-2-ylmethyl 4-chlorobenzoate is 236.02 g/mol.
Where can I buy Furan-2-ylmethyl 4-chlorobenzoate?
You can request a quote for Furan-2-ylmethyl 4-chlorobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Furan-2-ylmethyl 4-chlorobenzoate?
Yes, KEHONG BIO provides custom synthesis services for Furan-2-ylmethyl 4-chlorobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.