(4-Chlorophenyl)methyl 2-bromobenzoate
TL;DR: (4-Chlorophenyl)methyl 2-bromobenzoate (CAS 479607-79-9) is a chemical compound with molecular formula C14H10BrClO2 and molecular weight 323.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-chlorophenyl)methyl 2-bromobenzoate
Also Known As: 4-chlorobenzyl 2-bromobenzoate, (4-chlorophenyl)methyl 2-bromobenzoate
| Molecular Formula | C14H10BrClO2 |
|---|---|
| Molecular Weight | 323.96 g/mol |
| LogP | 4.4595 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 323.95526 |
| Heavy Atoms | 18 |
| Complexity | 551.9754 |
Chemical Identifiers
| CAS Number | 479607-79-9 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(=O)OCC2=CC=C(C=C2)Cl)Br |
Product Overview
(4-Chlorophenyl)methyl 2-bromobenzoate (CAS 479607-79-9), with molecular formula C14H10BrClO2 and molecular weight 323.96 g/mol. IUPAC: (4-chlorophenyl)methyl 2-bromobenzoate.
Chemical Property Profile of (4-Chlorophenyl)methyl 2-bromobenzoate
Property Insights of (4-Chlorophenyl)methyl 2-bromobenzoate
The XLogP value of 4.4595 indicates that (4-Chlorophenyl)methyl 2-bromobenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, (4-Chlorophenyl)methyl 2-bromobenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (4-Chlorophenyl)methyl 2-bromobenzoate 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 (4-Chlorophenyl)methyl 2-bromobenzoate?
The CAS number of (4-Chlorophenyl)methyl 2-bromobenzoate is 479607-79-9.
What is the molecular formula of (4-Chlorophenyl)methyl 2-bromobenzoate?
The molecular formula of (4-Chlorophenyl)methyl 2-bromobenzoate is C14H10BrClO2.
What is the molecular weight of (4-Chlorophenyl)methyl 2-bromobenzoate?
The molecular weight of (4-Chlorophenyl)methyl 2-bromobenzoate is 323.96 g/mol.
Where can I buy (4-Chlorophenyl)methyl 2-bromobenzoate?
You can request a quote for (4-Chlorophenyl)methyl 2-bromobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-Chlorophenyl)methyl 2-bromobenzoate?
Yes, KEHONG BIO provides custom synthesis services for (4-Chlorophenyl)methyl 2-bromobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.