![2-[1,1'-Biphenyl]-4-yl-2-oxoethyl 4-bromobenzoate structure](/static/products/4347/4347-70-0.webp)
2-[1,1'-Biphenyl]-4-yl-2-oxoethyl 4-bromobenzoate
TL;DR: 2-[1,1'-Biphenyl]-4-yl-2-oxoethyl 4-bromobenzoate (CAS 4347-70-0) is a chemical compound with molecular formula C21H15BrO3 and molecular weight 394.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-oxo-2-(4-phenylphenyl)ethyl] 4-bromobenzoate
Also Known As: 2-[1,1'-biphenyl]-4-yl-2-oxoethyl 4-bromobenzoate, 2-oxo-2-(4-phenylphenyl)ethyl 4-bromobenzoate, 2-(biphenyl-4-yl)-2-oxoethyl 4-bromobenzoate, [2-oxo-2-(4-phenylphenyl)ethyl] 4-bromobenzoate, AE-848/10319060
| Molecular Formula | C21H15BrO3 |
|---|---|
| Molecular Weight | 394.02 g/mol |
| LogP | 5.1558 |
| Topological Polar Surface Area | 43.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 394.02045 |
| Heavy Atoms | 25 |
| Complexity | 869.2794 |
Chemical Identifiers
| CAS Number | 4347-70-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)COC(=O)C3=CC=C(C=C3)Br |
Product Overview
2-[1,1'-Biphenyl]-4-yl-2-oxoethyl 4-bromobenzoate (CAS 4347-70-0), with molecular formula C21H15BrO3 and molecular weight 394.02 g/mol. IUPAC: [2-oxo-2-(4-phenylphenyl)ethyl] 4-bromobenzoate.
Chemical Property Profile of 2-[1,1'-Biphenyl]-4-yl-2-oxoethyl 4-bromobenzoate
Property Insights of 2-[1,1'-Biphenyl]-4-yl-2-oxoethyl 4-bromobenzoate
The XLogP value of 5.1558 indicates that 2-[1,1'-Biphenyl]-4-yl-2-oxoethyl 4-bromobenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.37 Ų, 2-[1,1'-Biphenyl]-4-yl-2-oxoethyl 4-bromobenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[1,1'-Biphenyl]-4-yl-2-oxoethyl 4-bromobenzoate 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 2-[1,1'-Biphenyl]-4-yl-2-oxoethyl 4-bromobenzoate?
The CAS number of 2-[1,1'-Biphenyl]-4-yl-2-oxoethyl 4-bromobenzoate is 4347-70-0.
What is the molecular formula of 2-[1,1'-Biphenyl]-4-yl-2-oxoethyl 4-bromobenzoate?
The molecular formula of 2-[1,1'-Biphenyl]-4-yl-2-oxoethyl 4-bromobenzoate is C21H15BrO3.
What is the molecular weight of 2-[1,1'-Biphenyl]-4-yl-2-oxoethyl 4-bromobenzoate?
The molecular weight of 2-[1,1'-Biphenyl]-4-yl-2-oxoethyl 4-bromobenzoate is 394.02 g/mol.
Where can I buy 2-[1,1'-Biphenyl]-4-yl-2-oxoethyl 4-bromobenzoate?
You can request a quote for 2-[1,1'-Biphenyl]-4-yl-2-oxoethyl 4-bromobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[1,1'-Biphenyl]-4-yl-2-oxoethyl 4-bromobenzoate?
Yes, KEHONG BIO provides custom synthesis services for 2-[1,1'-Biphenyl]-4-yl-2-oxoethyl 4-bromobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.