![4-Bromobenzyl 4-[(4-bromophenoxy)methyl]benzoate structure](/static/products/6649/664975-99-9.webp)
4-Bromobenzyl 4-[(4-bromophenoxy)methyl]benzoate
TL;DR: 4-Bromobenzyl 4-[(4-bromophenoxy)methyl]benzoate (CAS 664975-99-9) is a chemical compound with molecular formula C21H16Br2O3 and molecular weight 473.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-bromophenyl)methyl 4-[(4-bromophenoxy)methyl]benzoate
Also Known As: 4-bromobenzyl 4-[(4-bromophenoxy)methyl]benzoate, (4-bromophenyl)methyl 4-[(4-bromophenoxy)methyl]benzoate
| Molecular Formula | C21H16Br2O3 |
|---|---|
| Molecular Weight | 473.95 g/mol |
| LogP | 6.1476 |
| Topological Polar Surface Area | 35.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 473.94662 |
| Heavy Atoms | 26 |
| Complexity | 857.2679 |
Chemical Identifiers
| CAS Number | 664975-99-9 |
|---|---|
| SMILES | C1=CC(=CC=C1COC2=CC=C(C=C2)Br)C(=O)OCC3=CC=C(C=C3)Br |
Product Overview
4-Bromobenzyl 4-[(4-bromophenoxy)methyl]benzoate (CAS 664975-99-9), with molecular formula C21H16Br2O3 and molecular weight 473.95 g/mol. IUPAC: (4-bromophenyl)methyl 4-[(4-bromophenoxy)methyl]benzoate.
Chemical Property Profile of 4-Bromobenzyl 4-[(4-bromophenoxy)methyl]benzoate
Property Insights of 4-Bromobenzyl 4-[(4-bromophenoxy)methyl]benzoate
The XLogP value of 6.1476 indicates that 4-Bromobenzyl 4-[(4-bromophenoxy)methyl]benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.53 Ų, 4-Bromobenzyl 4-[(4-bromophenoxy)methyl]benzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Bromobenzyl 4-[(4-bromophenoxy)methyl]benzoate has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-Bromobenzyl 4-[(4-bromophenoxy)methyl]benzoate?
The CAS number of 4-Bromobenzyl 4-[(4-bromophenoxy)methyl]benzoate is 664975-99-9.
What is the molecular formula of 4-Bromobenzyl 4-[(4-bromophenoxy)methyl]benzoate?
The molecular formula of 4-Bromobenzyl 4-[(4-bromophenoxy)methyl]benzoate is C21H16Br2O3.
What is the molecular weight of 4-Bromobenzyl 4-[(4-bromophenoxy)methyl]benzoate?
The molecular weight of 4-Bromobenzyl 4-[(4-bromophenoxy)methyl]benzoate is 473.95 g/mol.
Where can I buy 4-Bromobenzyl 4-[(4-bromophenoxy)methyl]benzoate?
You can request a quote for 4-Bromobenzyl 4-[(4-bromophenoxy)methyl]benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Bromobenzyl 4-[(4-bromophenoxy)methyl]benzoate?
Yes, KEHONG BIO provides custom synthesis services for 4-Bromobenzyl 4-[(4-bromophenoxy)methyl]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.