(4-Bromophenyl)methyl 3,4-dimethoxybenzoate
TL;DR: (4-Bromophenyl)methyl 3,4-dimethoxybenzoate (CAS 380441-39-4) is a chemical compound with molecular formula C16H15BrO4 and molecular weight 350.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-bromophenyl)methyl 3,4-dimethoxybenzoate
Also Known As: (4-bromophenyl)methyl 3,4-dimethoxybenzoate, 4-bromobenzyl 3,4-dimethoxybenzoate, AB01315723-02, AJ-292/41945197
| Molecular Formula | C16H15BrO4 |
|---|---|
| Molecular Weight | 350.02 g/mol |
| LogP | 3.8233 |
| Topological Polar Surface Area | 44.76 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 350.01538 |
| Heavy Atoms | 21 |
| Complexity | 622.67413 |
Chemical Identifiers
| CAS Number | 380441-39-4 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C(=O)OCC2=CC=C(C=C2)Br)OC |
Product Overview
(4-Bromophenyl)methyl 3,4-dimethoxybenzoate (CAS 380441-39-4), with molecular formula C16H15BrO4 and molecular weight 350.02 g/mol. IUPAC: (4-bromophenyl)methyl 3,4-dimethoxybenzoate.
Chemical Property Profile of (4-Bromophenyl)methyl 3,4-dimethoxybenzoate
Property Insights of (4-Bromophenyl)methyl 3,4-dimethoxybenzoate
The XLogP value of 3.8233 indicates that (4-Bromophenyl)methyl 3,4-dimethoxybenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.76 Ų, (4-Bromophenyl)methyl 3,4-dimethoxybenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (4-Bromophenyl)methyl 3,4-dimethoxybenzoate has 0 hydrogen bond donor(s) and 4 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-Bromophenyl)methyl 3,4-dimethoxybenzoate?
The CAS number of (4-Bromophenyl)methyl 3,4-dimethoxybenzoate is 380441-39-4.
What is the molecular formula of (4-Bromophenyl)methyl 3,4-dimethoxybenzoate?
The molecular formula of (4-Bromophenyl)methyl 3,4-dimethoxybenzoate is C16H15BrO4.
What is the molecular weight of (4-Bromophenyl)methyl 3,4-dimethoxybenzoate?
The molecular weight of (4-Bromophenyl)methyl 3,4-dimethoxybenzoate is 350.02 g/mol.
Where can I buy (4-Bromophenyl)methyl 3,4-dimethoxybenzoate?
You can request a quote for (4-Bromophenyl)methyl 3,4-dimethoxybenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-Bromophenyl)methyl 3,4-dimethoxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for (4-Bromophenyl)methyl 3,4-dimethoxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.