2-Bromo-4-ethylphenyl 2-chlorobenzoate
TL;DR: 2-Bromo-4-ethylphenyl 2-chlorobenzoate (CAS 514823-86-0) is a chemical compound with molecular formula C15H12BrClO2 and molecular weight 337.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-bromo-4-ethylphenyl) 2-chlorobenzoate
Also Known As: 2-bromo-4-ethylphenyl 2-chlorobenzoate, (2-bromo-4-ethylphenyl) 2-chlorobenzoate, AN-329/41583559
| Molecular Formula | C15H12BrClO2 |
|---|---|
| Molecular Weight | 337.97 g/mol |
| LogP | 4.8841 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 337.97092 |
| Heavy Atoms | 19 |
| Complexity | 610.8446 |
Chemical Identifiers
| CAS Number | 514823-86-0 |
|---|---|
| SMILES | CCC1=CC(=C(C=C1)OC(=O)C2=CC=CC=C2Cl)Br |
Product Overview
2-Bromo-4-ethylphenyl 2-chlorobenzoate (CAS 514823-86-0), with molecular formula C15H12BrClO2 and molecular weight 337.97 g/mol. IUPAC: (2-bromo-4-ethylphenyl) 2-chlorobenzoate.
Chemical Property Profile of 2-Bromo-4-ethylphenyl 2-chlorobenzoate
Property Insights of 2-Bromo-4-ethylphenyl 2-chlorobenzoate
The XLogP value of 4.8841 indicates that 2-Bromo-4-ethylphenyl 2-chlorobenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 2-Bromo-4-ethylphenyl 2-chlorobenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Bromo-4-ethylphenyl 2-chlorobenzoate 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 2-Bromo-4-ethylphenyl 2-chlorobenzoate?
The CAS number of 2-Bromo-4-ethylphenyl 2-chlorobenzoate is 514823-86-0.
What is the molecular formula of 2-Bromo-4-ethylphenyl 2-chlorobenzoate?
The molecular formula of 2-Bromo-4-ethylphenyl 2-chlorobenzoate is C15H12BrClO2.
What is the molecular weight of 2-Bromo-4-ethylphenyl 2-chlorobenzoate?
The molecular weight of 2-Bromo-4-ethylphenyl 2-chlorobenzoate is 337.97 g/mol.
Where can I buy 2-Bromo-4-ethylphenyl 2-chlorobenzoate?
You can request a quote for 2-Bromo-4-ethylphenyl 2-chlorobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Bromo-4-ethylphenyl 2-chlorobenzoate?
Yes, KEHONG BIO provides custom synthesis services for 2-Bromo-4-ethylphenyl 2-chlorobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.