Ethyl 2-bromo-2-(4-fluorophenyl)acetate
TL;DR: Ethyl 2-bromo-2-(4-fluorophenyl)acetate (CAS 712-52-7) is a chemical compound with molecular formula C10H10BrFO2 and molecular weight 259.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-bromo-2-(4-fluorophenyl)acetate
Also Known As: ethyl 2-bromo-2-(4-fluorophenyl)acetate, ethyl bromo(4-fluorophenyl)acetate, ETHYL BROMO-(4-FLUORO-PHENYL)-ACETATE, BROMO-(4-FLUORO-PHENYL)-ACETIC ACID ETHYL ESTER, BROMO- -ACETICACIDETHYLESTER
| Molecular Formula | C10H10BrFO2 |
|---|---|
| Molecular Weight | 259.98 g/mol |
| LogP | 2.8248 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 259.98483 |
| Heavy Atoms | 14 |
| Complexity | 310.40295 |
Chemical Identifiers
| CAS Number | 712-52-7 |
|---|---|
| SMILES | CCOC(=O)C(C1=CC=C(C=C1)F)Br |
Product Overview
Ethyl 2-bromo-2-(4-fluorophenyl)acetate (CAS 712-52-7), with molecular formula C10H10BrFO2 and molecular weight 259.98 g/mol. IUPAC: ethyl 2-bromo-2-(4-fluorophenyl)acetate.
Chemical Property Profile of Ethyl 2-bromo-2-(4-fluorophenyl)acetate
Property Insights of Ethyl 2-bromo-2-(4-fluorophenyl)acetate
The XLogP value of 2.8248 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-bromo-2-(4-fluorophenyl)acetate. With a topological polar surface area (TPSA) of 26.3 Ų, Ethyl 2-bromo-2-(4-fluorophenyl)acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 2-bromo-2-(4-fluorophenyl)acetate 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 Ethyl 2-bromo-2-(4-fluorophenyl)acetate?
The CAS number of Ethyl 2-bromo-2-(4-fluorophenyl)acetate is 712-52-7.
What is the molecular formula of Ethyl 2-bromo-2-(4-fluorophenyl)acetate?
The molecular formula of Ethyl 2-bromo-2-(4-fluorophenyl)acetate is C10H10BrFO2.
What is the molecular weight of Ethyl 2-bromo-2-(4-fluorophenyl)acetate?
The molecular weight of Ethyl 2-bromo-2-(4-fluorophenyl)acetate is 259.98 g/mol.
Where can I buy Ethyl 2-bromo-2-(4-fluorophenyl)acetate?
You can request a quote for Ethyl 2-bromo-2-(4-fluorophenyl)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-bromo-2-(4-fluorophenyl)acetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-bromo-2-(4-fluorophenyl)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.