(E)-2-chlorophenyl 3-(furan-2-yl)acrylate
TL;DR: (E)-2-chlorophenyl 3-(furan-2-yl)acrylate (CAS 494830-76-1) is a chemical compound with molecular formula C13H9ClO3 and molecular weight 248.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-chlorophenyl) (E)-3-(furan-2-yl)prop-2-enoate
Also Known As: 2-chlorophenyl 3-(2-furyl)acrylate, (E)-2-chlorophenyl 3-(furan-2-yl)acrylate, (2-chlorophenyl) 3-(2-furyl)prop-2-enoate, 2-chlorophenyl (2E)-3-(2-furyl)prop-2-enoate, 2-chlorophenyl (2E)-3-(furan-2-yl)prop-2-enoate
| Molecular Formula | C13H9ClO3 |
|---|---|
| Molecular Weight | 248.02 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 39.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 248.02402 |
| Heavy Atoms | 17 |
| Complexity | 290.0 |
Chemical Identifiers
| CAS Number | 494830-76-1 |
|---|---|
| SMILES | C1=CC=C(C(=C1)OC(=O)/C=C/C2=CC=CO2)Cl |
| InChIKey | AEPPTDDUKBQBCX-BQYQJAHWSA-N |
Product Overview
(E)-2-chlorophenyl 3-(furan-2-yl)acrylate (CAS 494830-76-1), with molecular formula C13H9ClO3 and molecular weight 248.02 g/mol. IUPAC: (2-chlorophenyl) (E)-3-(furan-2-yl)prop-2-enoate.
Chemical Property Profile of (E)-2-chlorophenyl 3-(furan-2-yl)acrylate
Property Insights of (E)-2-chlorophenyl 3-(furan-2-yl)acrylate
The XLogP value of 3.5 indicates that (E)-2-chlorophenyl 3-(furan-2-yl)acrylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.4 Ų, (E)-2-chlorophenyl 3-(furan-2-yl)acrylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-2-chlorophenyl 3-(furan-2-yl)acrylate 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 (E)-2-chlorophenyl 3-(furan-2-yl)acrylate?
The CAS number of (E)-2-chlorophenyl 3-(furan-2-yl)acrylate is 494830-76-1.
What is the molecular formula of (E)-2-chlorophenyl 3-(furan-2-yl)acrylate?
The molecular formula of (E)-2-chlorophenyl 3-(furan-2-yl)acrylate is C13H9ClO3.
What is the molecular weight of (E)-2-chlorophenyl 3-(furan-2-yl)acrylate?
The molecular weight of (E)-2-chlorophenyl 3-(furan-2-yl)acrylate is 248.02 g/mol.
Where can I buy (E)-2-chlorophenyl 3-(furan-2-yl)acrylate?
You can request a quote for (E)-2-chlorophenyl 3-(furan-2-yl)acrylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-2-chlorophenyl 3-(furan-2-yl)acrylate?
Yes, KEHONG BIO provides custom synthesis services for (E)-2-chlorophenyl 3-(furan-2-yl)acrylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.