(2-Bromo-4-methylphenyl) 4-phenylbenzoate
TL;DR: (2-Bromo-4-methylphenyl) 4-phenylbenzoate (CAS 445408-97-9) is a chemical compound with molecular formula C20H15BrO2 and molecular weight 366.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-bromo-4-methylphenyl) 4-phenylbenzoate
Also Known As: (2-bromo-4-methylphenyl) 4-phenylbenzoate, 2-bromo-4-methylphenyl 4-biphenylcarboxylate, 2-bromo-4-methylphenyl 4-phenylbenzoate, 2-bromo-4-methylphenyl biphenyl-4-carboxylate, AN-329/40887401
| Molecular Formula | C20H15BrO2 |
|---|---|
| Molecular Weight | 366.03 g/mol |
| LogP | 5.64372 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 366.02554 |
| Heavy Atoms | 23 |
| Complexity | 824.0203 |
Chemical Identifiers
| CAS Number | 445408-97-9 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)OC(=O)C2=CC=C(C=C2)C3=CC=CC=C3)Br |
Product Overview
(2-Bromo-4-methylphenyl) 4-phenylbenzoate (CAS 445408-97-9), with molecular formula C20H15BrO2 and molecular weight 366.03 g/mol. IUPAC: (2-bromo-4-methylphenyl) 4-phenylbenzoate.
Chemical Property Profile of (2-Bromo-4-methylphenyl) 4-phenylbenzoate
Property Insights of (2-Bromo-4-methylphenyl) 4-phenylbenzoate
The XLogP value of 5.64372 indicates that (2-Bromo-4-methylphenyl) 4-phenylbenzoate 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-methylphenyl) 4-phenylbenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2-Bromo-4-methylphenyl) 4-phenylbenzoate has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (2-Bromo-4-methylphenyl) 4-phenylbenzoate?
The CAS number of (2-Bromo-4-methylphenyl) 4-phenylbenzoate is 445408-97-9.
What is the molecular formula of (2-Bromo-4-methylphenyl) 4-phenylbenzoate?
The molecular formula of (2-Bromo-4-methylphenyl) 4-phenylbenzoate is C20H15BrO2.
What is the molecular weight of (2-Bromo-4-methylphenyl) 4-phenylbenzoate?
The molecular weight of (2-Bromo-4-methylphenyl) 4-phenylbenzoate is 366.03 g/mol.
Where can I buy (2-Bromo-4-methylphenyl) 4-phenylbenzoate?
You can request a quote for (2-Bromo-4-methylphenyl) 4-phenylbenzoate 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-methylphenyl) 4-phenylbenzoate?
Yes, KEHONG BIO provides custom synthesis services for (2-Bromo-4-methylphenyl) 4-phenylbenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.