3,4-Diacetyloxy-2-iodobenzoate
TL;DR: 3,4-Diacetyloxy-2-iodobenzoate (CAS 67106-44-9) is a chemical compound with molecular formula C11H8IO6- and molecular weight 362.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4-diacetyloxy-2-iodobenzoate
Also Known As: 2-Diacetoxyiodobenzoate, 3,4-diacetyloxy-2-iodobenzoate, 3,4-diacetyloxy-2-iodo-benzoate
| Molecular Formula | C11H8IO6- |
|---|---|
| Molecular Weight | 362.94 g/mol |
| LogP | 0.5053 |
| Topological Polar Surface Area | 92.73 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 362.93655 |
| Heavy Atoms | 18 |
| Complexity | 522.5099 |
Chemical Identifiers
| CAS Number | 67106-44-9 |
|---|---|
| SMILES | CC(=O)OC1=C(C(=C(C=C1)C(=O)[O-])I)OC(=O)C |
Product Overview
3,4-Diacetyloxy-2-iodobenzoate (CAS 67106-44-9), with molecular formula C11H8IO6- and molecular weight 362.94 g/mol. IUPAC: 3,4-diacetyloxy-2-iodobenzoate.
Chemical Property Profile of 3,4-Diacetyloxy-2-iodobenzoate
Property Insights of 3,4-Diacetyloxy-2-iodobenzoate
The XLogP value of 0.5053 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,4-Diacetyloxy-2-iodobenzoate. The TPSA of 92.73 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,4-Diacetyloxy-2-iodobenzoate. Following Lipinski's Rule of Five, 3,4-Diacetyloxy-2-iodobenzoate has 0 hydrogen bond donor(s) and 6 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 3,4-Diacetyloxy-2-iodobenzoate?
The CAS number of 3,4-Diacetyloxy-2-iodobenzoate is 67106-44-9.
What is the molecular formula of 3,4-Diacetyloxy-2-iodobenzoate?
The molecular formula of 3,4-Diacetyloxy-2-iodobenzoate is C11H8IO6-.
What is the molecular weight of 3,4-Diacetyloxy-2-iodobenzoate?
The molecular weight of 3,4-Diacetyloxy-2-iodobenzoate is 362.94 g/mol.
Where can I buy 3,4-Diacetyloxy-2-iodobenzoate?
You can request a quote for 3,4-Diacetyloxy-2-iodobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4-Diacetyloxy-2-iodobenzoate?
Yes, KEHONG BIO provides custom synthesis services for 3,4-Diacetyloxy-2-iodobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.