8-iodo-4-methyl-2-oxo-2H-chromen-7-yl acetate
TL;DR: 8-iodo-4-methyl-2-oxo-2H-chromen-7-yl acetate (CAS 343217-96-9) is a chemical compound with molecular formula C12H9IO4 and molecular weight 343.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(8-iodo-4-methyl-2-oxochromen-7-yl) acetate
Also Known As: 7-acetoxy-8-iodo-4-methylcoumarin, 8-iodo-4-methyl-2-oxo-2H-chromen-7-yl acetate, BIM-0045034.P001, 8-iodo-4-methyl-2-oxochromen-7-yl acetate, J1.890.540J
| Molecular Formula | C12H9IO4 |
|---|---|
| Molecular Weight | 343.95 g/mol |
| LogP | 2.63132 |
| Topological Polar Surface Area | 56.51 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 343.95456 |
| Heavy Atoms | 17 |
| Complexity | 657.3386 |
Chemical Identifiers
| CAS Number | 343217-96-9 |
|---|---|
| SMILES | CC1=CC(=O)OC2=C1C=CC(=C2I)OC(=O)C |
Product Overview
8-iodo-4-methyl-2-oxo-2H-chromen-7-yl acetate (CAS 343217-96-9), with molecular formula C12H9IO4 and molecular weight 343.95 g/mol. IUPAC: (8-iodo-4-methyl-2-oxochromen-7-yl) acetate.
Chemical Property Profile of 8-iodo-4-methyl-2-oxo-2H-chromen-7-yl acetate
Property Insights of 8-iodo-4-methyl-2-oxo-2H-chromen-7-yl acetate
The XLogP value of 2.63132 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-iodo-4-methyl-2-oxo-2H-chromen-7-yl acetate. With a topological polar surface area (TPSA) of 56.51 Ų, 8-iodo-4-methyl-2-oxo-2H-chromen-7-yl acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 8-iodo-4-methyl-2-oxo-2H-chromen-7-yl acetate 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 8-iodo-4-methyl-2-oxo-2H-chromen-7-yl acetate?
The CAS number of 8-iodo-4-methyl-2-oxo-2H-chromen-7-yl acetate is 343217-96-9.
What is the molecular formula of 8-iodo-4-methyl-2-oxo-2H-chromen-7-yl acetate?
The molecular formula of 8-iodo-4-methyl-2-oxo-2H-chromen-7-yl acetate is C12H9IO4.
What is the molecular weight of 8-iodo-4-methyl-2-oxo-2H-chromen-7-yl acetate?
The molecular weight of 8-iodo-4-methyl-2-oxo-2H-chromen-7-yl acetate is 343.95 g/mol.
Where can I buy 8-iodo-4-methyl-2-oxo-2H-chromen-7-yl acetate?
You can request a quote for 8-iodo-4-methyl-2-oxo-2H-chromen-7-yl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-iodo-4-methyl-2-oxo-2H-chromen-7-yl acetate?
Yes, KEHONG BIO provides custom synthesis services for 8-iodo-4-methyl-2-oxo-2H-chromen-7-yl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.