2-(4-Bromophenyl)-2-oxoethyl 2-iodobenzoate
TL;DR: 2-(4-Bromophenyl)-2-oxoethyl 2-iodobenzoate (CAS 53756-59-5) is a chemical compound with molecular formula C15H10BrIO3 and molecular weight 443.89 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(4-bromophenyl)-2-oxoethyl] 2-iodobenzoate
Also Known As: 2-(4-bromophenyl)-2-oxoethyl 2-iodobenzoate, BAS 00293901, 2-Iodo-benzoic acid 2-(4-bromo-phenyl)-2-oxo-ethyl ester
| Molecular Formula | C15H10BrIO3 |
|---|---|
| Molecular Weight | 443.89 g/mol |
| LogP | 4.0934 |
| Topological Polar Surface Area | 43.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 443.8858 |
| Heavy Atoms | 20 |
| Complexity | 637.82184 |
Chemical Identifiers
| CAS Number | 53756-59-5 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(=O)OCC(=O)C2=CC=C(C=C2)Br)I |
Product Overview
2-(4-Bromophenyl)-2-oxoethyl 2-iodobenzoate (CAS 53756-59-5), with molecular formula C15H10BrIO3 and molecular weight 443.89 g/mol. IUPAC: [2-(4-bromophenyl)-2-oxoethyl] 2-iodobenzoate.
Chemical Property Profile of 2-(4-Bromophenyl)-2-oxoethyl 2-iodobenzoate
Property Insights of 2-(4-Bromophenyl)-2-oxoethyl 2-iodobenzoate
The XLogP value of 4.0934 indicates that 2-(4-Bromophenyl)-2-oxoethyl 2-iodobenzoate 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-(4-Bromophenyl)-2-oxoethyl 2-iodobenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Bromophenyl)-2-oxoethyl 2-iodobenzoate has 0 hydrogen bond donor(s) and 3 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 2-(4-Bromophenyl)-2-oxoethyl 2-iodobenzoate?
The CAS number of 2-(4-Bromophenyl)-2-oxoethyl 2-iodobenzoate is 53756-59-5.
What is the molecular formula of 2-(4-Bromophenyl)-2-oxoethyl 2-iodobenzoate?
The molecular formula of 2-(4-Bromophenyl)-2-oxoethyl 2-iodobenzoate is C15H10BrIO3.
What is the molecular weight of 2-(4-Bromophenyl)-2-oxoethyl 2-iodobenzoate?
The molecular weight of 2-(4-Bromophenyl)-2-oxoethyl 2-iodobenzoate is 443.89 g/mol.
Where can I buy 2-(4-Bromophenyl)-2-oxoethyl 2-iodobenzoate?
You can request a quote for 2-(4-Bromophenyl)-2-oxoethyl 2-iodobenzoate 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 2-iodobenzoate?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Bromophenyl)-2-oxoethyl 2-iodobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.