(4-Bromophenyl)methyl 4-methylbenzoate
TL;DR: (4-Bromophenyl)methyl 4-methylbenzoate (CAS 108939-26-0) is a chemical compound with molecular formula C15H13BrO2 and molecular weight 304.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-bromophenyl)methyl 4-methylbenzoate
Also Known As: 4-bromobenzyl 4-methylbenzoate, (4-bromophenyl)methyl 4-methylbenzoate
| Molecular Formula | C15H13BrO2 |
|---|---|
| Molecular Weight | 304.01 g/mol |
| LogP | 4.11452 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 304.0099 |
| Heavy Atoms | 18 |
| Complexity | 529.425 |
Chemical Identifiers
| CAS Number | 108939-26-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)OCC2=CC=C(C=C2)Br |
Product Overview
(4-Bromophenyl)methyl 4-methylbenzoate (CAS 108939-26-0), with molecular formula C15H13BrO2 and molecular weight 304.01 g/mol. IUPAC: (4-bromophenyl)methyl 4-methylbenzoate.
Chemical Property Profile of (4-Bromophenyl)methyl 4-methylbenzoate
Property Insights of (4-Bromophenyl)methyl 4-methylbenzoate
The XLogP value of 4.11452 indicates that (4-Bromophenyl)methyl 4-methylbenzoate 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-Bromophenyl)methyl 4-methylbenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (4-Bromophenyl)methyl 4-methylbenzoate 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-Bromophenyl)methyl 4-methylbenzoate?
The CAS number of (4-Bromophenyl)methyl 4-methylbenzoate is 108939-26-0.
What is the molecular formula of (4-Bromophenyl)methyl 4-methylbenzoate?
The molecular formula of (4-Bromophenyl)methyl 4-methylbenzoate is C15H13BrO2.
What is the molecular weight of (4-Bromophenyl)methyl 4-methylbenzoate?
The molecular weight of (4-Bromophenyl)methyl 4-methylbenzoate is 304.01 g/mol.
Where can I buy (4-Bromophenyl)methyl 4-methylbenzoate?
You can request a quote for (4-Bromophenyl)methyl 4-methylbenzoate 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 4-methylbenzoate?
Yes, KEHONG BIO provides custom synthesis services for (4-Bromophenyl)methyl 4-methylbenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.