(E)-3-(5-bromo-2-fluorophenyl)prop-2-enoate
TL;DR: (E)-3-(5-bromo-2-fluorophenyl)prop-2-enoate (CAS 202865-71-2) is a chemical compound with molecular formula C9H5BrFO2- and molecular weight 242.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-(5-bromo-2-fluorophenyl)prop-2-enoate
Also Known As: 5-Bromo-2-fluorocinnamicacid, 5-Bromo-2-fluorocinnamic acid, (E)-3-(5-bromo-2-fluorophenyl)prop-2-enoate
| Molecular Formula | C9H5BrFO2- |
|---|---|
| Molecular Weight | 242.95 g/mol |
| LogP | 1.3513 |
| Topological Polar Surface Area | 40.13 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 242.9457 |
| Heavy Atoms | 13 |
| Complexity | 360.6324 |
Chemical Identifiers
| CAS Number | 202865-71-2 |
|---|---|
| SMILES | C1=CC(=C(C=C1Br)/C=C/C(=O)[O-])F |
Product Overview
(E)-3-(5-bromo-2-fluorophenyl)prop-2-enoate (CAS 202865-71-2), with molecular formula C9H5BrFO2- and molecular weight 242.95 g/mol. IUPAC: (E)-3-(5-bromo-2-fluorophenyl)prop-2-enoate.
Chemical Property Profile of (E)-3-(5-bromo-2-fluorophenyl)prop-2-enoate
Property Insights of (E)-3-(5-bromo-2-fluorophenyl)prop-2-enoate
The XLogP value of 1.3513 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-3-(5-bromo-2-fluorophenyl)prop-2-enoate. With a topological polar surface area (TPSA) of 40.13 Ų, (E)-3-(5-bromo-2-fluorophenyl)prop-2-enoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-3-(5-bromo-2-fluorophenyl)prop-2-enoate has 0 hydrogen bond donor(s) and 2 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)-3-(5-bromo-2-fluorophenyl)prop-2-enoate?
The CAS number of (E)-3-(5-bromo-2-fluorophenyl)prop-2-enoate is 202865-71-2.
What is the molecular formula of (E)-3-(5-bromo-2-fluorophenyl)prop-2-enoate?
The molecular formula of (E)-3-(5-bromo-2-fluorophenyl)prop-2-enoate is C9H5BrFO2-.
What is the molecular weight of (E)-3-(5-bromo-2-fluorophenyl)prop-2-enoate?
The molecular weight of (E)-3-(5-bromo-2-fluorophenyl)prop-2-enoate is 242.95 g/mol.
Where can I buy (E)-3-(5-bromo-2-fluorophenyl)prop-2-enoate?
You can request a quote for (E)-3-(5-bromo-2-fluorophenyl)prop-2-enoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-3-(5-bromo-2-fluorophenyl)prop-2-enoate?
Yes, KEHONG BIO provides custom synthesis services for (E)-3-(5-bromo-2-fluorophenyl)prop-2-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.