Acetic acid 4-formyl-2-iodo-phenyl ester
TL;DR: Acetic acid 4-formyl-2-iodo-phenyl ester (CAS 166803-90-3) is a chemical compound with molecular formula C9H7IO3 and molecular weight 289.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-formyl-2-iodophenyl) acetate
Also Known As: 4-formyl-2-iodophenyl acetate, (4-formyl-2-iodo-phenyl) Acetate, Acetic acid 4-formyl-2-iodo-phenyl ester
| Molecular Formula | C9H7IO3 |
|---|---|
| Molecular Weight | 289.94 g/mol |
| LogP | 2.029 |
| Topological Polar Surface Area | 43.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 289.944 |
| Heavy Atoms | 13 |
| Complexity | 346.7131 |
Chemical Identifiers
| CAS Number | 166803-90-3 |
|---|---|
| SMILES | CC(=O)OC1=C(C=C(C=C1)C=O)I |
Product Overview
Acetic acid 4-formyl-2-iodo-phenyl ester (CAS 166803-90-3), with molecular formula C9H7IO3 and molecular weight 289.94 g/mol. IUPAC: (4-formyl-2-iodophenyl) acetate.
Chemical Property Profile of Acetic acid 4-formyl-2-iodo-phenyl ester
Property Insights of Acetic acid 4-formyl-2-iodo-phenyl ester
The XLogP value of 2.029 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetic acid 4-formyl-2-iodo-phenyl ester. With a topological polar surface area (TPSA) of 43.37 Ų, Acetic acid 4-formyl-2-iodo-phenyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Acetic acid 4-formyl-2-iodo-phenyl ester 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 Acetic acid 4-formyl-2-iodo-phenyl ester?
The CAS number of Acetic acid 4-formyl-2-iodo-phenyl ester is 166803-90-3.
What is the molecular formula of Acetic acid 4-formyl-2-iodo-phenyl ester?
The molecular formula of Acetic acid 4-formyl-2-iodo-phenyl ester is C9H7IO3.
What is the molecular weight of Acetic acid 4-formyl-2-iodo-phenyl ester?
The molecular weight of Acetic acid 4-formyl-2-iodo-phenyl ester is 289.94 g/mol.
Where can I buy Acetic acid 4-formyl-2-iodo-phenyl ester?
You can request a quote for Acetic acid 4-formyl-2-iodo-phenyl 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 4-formyl-2-iodo-phenyl ester?
Yes, KEHONG BIO provides custom synthesis services for Acetic acid 4-formyl-2-iodo-phenyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.