Acetic acid, phenoxy-, p-bromophenacyl ester
TL;DR: Acetic acid, phenoxy-, p-bromophenacyl ester (CAS 73622-65-8) is a chemical compound with molecular formula C16H13BrO4 and molecular weight 348.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(4-bromophenyl)-2-oxoethyl] 2-phenoxyacetate
Also Known As: p-Bromophenacyl phenoxyacetate, 4-bromophenacyl phenoxyacetate, 2-(4-bromophenyl)-2-oxoethyl phenoxyacetate, ACETIC ACID, PHENOXY-, p-BROMOPHENACYL ESTER, 2-(4-bromophenyl)-2-oxoethyl 2-phenoxyacetate
| Molecular Formula | C16H13BrO4 |
|---|---|
| Molecular Weight | 348.00 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 347.99973 |
| Heavy Atoms | 21 |
| Complexity | 344.0 |
Chemical Identifiers
| CAS Number | 73622-65-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)OCC(=O)OCC(=O)C2=CC=C(C=C2)Br |
| InChIKey | ZWQQVIQRTFKJHI-UHFFFAOYSA-N |
Product Overview
Acetic acid, phenoxy-, p-bromophenacyl ester (CAS 73622-65-8), with molecular formula C16H13BrO4 and molecular weight 348.00 g/mol. IUPAC: [2-(4-bromophenyl)-2-oxoethyl] 2-phenoxyacetate.
Chemical Property Profile of Acetic acid, phenoxy-, p-bromophenacyl ester
Property Insights of Acetic acid, phenoxy-, p-bromophenacyl ester
The XLogP value of 3.9 indicates that Acetic acid, phenoxy-, p-bromophenacyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, Acetic acid, phenoxy-, p-bromophenacyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Acetic acid, phenoxy-, p-bromophenacyl ester 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 Acetic acid, phenoxy-, p-bromophenacyl ester?
The CAS number of Acetic acid, phenoxy-, p-bromophenacyl ester is 73622-65-8.
What is the molecular formula of Acetic acid, phenoxy-, p-bromophenacyl ester?
The molecular formula of Acetic acid, phenoxy-, p-bromophenacyl ester is C16H13BrO4.
What is the molecular weight of Acetic acid, phenoxy-, p-bromophenacyl ester?
The molecular weight of Acetic acid, phenoxy-, p-bromophenacyl ester is 348.00 g/mol.
Where can I buy Acetic acid, phenoxy-, p-bromophenacyl ester?
You can request a quote for Acetic acid, phenoxy-, p-bromophenacyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetic acid, phenoxy-, p-bromophenacyl ester?
Yes, KEHONG BIO provides custom synthesis services for Acetic acid, phenoxy-, p-bromophenacyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.