2-(4-Bromophenyl)-2-oxoethyl diphenylacetate
TL;DR: 2-(4-Bromophenyl)-2-oxoethyl diphenylacetate (CAS 7598-27-8) is a chemical compound with molecular formula C22H17BrO3 and molecular weight 408.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(4-bromophenyl)-2-oxoethyl] 2,2-diphenylacetate
Also Known As: 2-(4-bromophenyl)-2-oxoethyl diphenylacetate, [2-(4-bromophenyl)-2-oxoethyl] 2,2-diphenylacetate, 2-(4-bromophenyl)-2-oxoethyl 2,2-diphenylacetate, A1143/0053449, RefChem:252004
| Molecular Formula | C22H17BrO3 |
|---|---|
| Molecular Weight | 408.04 g/mol |
| LogP | 5.5 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 408.0361 |
| Heavy Atoms | 26 |
| Complexity | 440.0 |
Chemical Identifiers
| CAS Number | 7598-27-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(C2=CC=CC=C2)C(=O)OCC(=O)C3=CC=C(C=C3)Br |
| InChIKey | UYVBQHDPGPQTCJ-UHFFFAOYSA-N |
Product Overview
2-(4-Bromophenyl)-2-oxoethyl diphenylacetate (CAS 7598-27-8), with molecular formula C22H17BrO3 and molecular weight 408.04 g/mol. IUPAC: [2-(4-bromophenyl)-2-oxoethyl] 2,2-diphenylacetate.
Chemical Property Profile of 2-(4-Bromophenyl)-2-oxoethyl diphenylacetate
Property Insights of 2-(4-Bromophenyl)-2-oxoethyl diphenylacetate
The XLogP value of 5.5 indicates that 2-(4-Bromophenyl)-2-oxoethyl diphenylacetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.4 Ų, 2-(4-Bromophenyl)-2-oxoethyl diphenylacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Bromophenyl)-2-oxoethyl diphenylacetate 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-(4-Bromophenyl)-2-oxoethyl diphenylacetate?
The CAS number of 2-(4-Bromophenyl)-2-oxoethyl diphenylacetate is 7598-27-8.
What is the molecular formula of 2-(4-Bromophenyl)-2-oxoethyl diphenylacetate?
The molecular formula of 2-(4-Bromophenyl)-2-oxoethyl diphenylacetate is C22H17BrO3.
What is the molecular weight of 2-(4-Bromophenyl)-2-oxoethyl diphenylacetate?
The molecular weight of 2-(4-Bromophenyl)-2-oxoethyl diphenylacetate is 408.04 g/mol.
Where can I buy 2-(4-Bromophenyl)-2-oxoethyl diphenylacetate?
You can request a quote for 2-(4-Bromophenyl)-2-oxoethyl diphenylacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Bromophenyl)-2-oxoethyl diphenylacetate?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Bromophenyl)-2-oxoethyl diphenylacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.