phenacyl 4-iodobenzoate
TL;DR: phenacyl 4-iodobenzoate (CAS 55153-29-2) is a chemical compound with molecular formula C15H11IO3 and molecular weight 365.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
phenacyl 4-iodobenzoate
Also Known As: phenacyl 4-iodobenzoate, 4-Iodobenzoic acid phenacyl ester, 2-Oxo-2-phenylethyl 4-iodobenzoate, Benzoic acid, 4-iodo-, 2-oxo-2-phenylethyl ester, RefChem:388670
| Molecular Formula | C15H11IO3 |
|---|---|
| Molecular Weight | 365.98 g/mol |
| LogP | 3.3309 |
| Topological Polar Surface Area | 43.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 365.97528 |
| Heavy Atoms | 19 |
| Complexity | 576.0995 |
Chemical Identifiers
| CAS Number | 55153-29-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)COC(=O)C2=CC=C(C=C2)I |
Product Overview
phenacyl 4-iodobenzoate (CAS 55153-29-2), with molecular formula C15H11IO3 and molecular weight 365.98 g/mol. IUPAC: phenacyl 4-iodobenzoate.
Chemical Property Profile of phenacyl 4-iodobenzoate
Property Insights of phenacyl 4-iodobenzoate
The XLogP value of 3.3309 indicates that phenacyl 4-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, phenacyl 4-iodobenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, phenacyl 4-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 phenacyl 4-iodobenzoate?
The CAS number of phenacyl 4-iodobenzoate is 55153-29-2.
What is the molecular formula of phenacyl 4-iodobenzoate?
The molecular formula of phenacyl 4-iodobenzoate is C15H11IO3.
What is the molecular weight of phenacyl 4-iodobenzoate?
The molecular weight of phenacyl 4-iodobenzoate is 365.98 g/mol.
Where can I buy phenacyl 4-iodobenzoate?
You can request a quote for phenacyl 4-iodobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for phenacyl 4-iodobenzoate?
Yes, KEHONG BIO provides custom synthesis services for phenacyl 4-iodobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.