(6,8-Diiodo-2-oxo-2h-chromene-3-carbonyl)-carbamic acid ethyl ester
TL;DR: (6,8-Diiodo-2-oxo-2h-chromene-3-carbonyl)-carbamic acid ethyl ester (CAS 353281-19-3) is a chemical compound with molecular formula C13H9I2NO5 and molecular weight 512.86 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl N-(6,8-diiodo-2-oxochromene-3-carbonyl)carbamate
Also Known As: (6,8-diiodo-2-oxo-2h-chromene-3-carbonyl)-carbamic acid ethyl ester, ethyl N-(6,8-diiodo-2-oxochromene-3-carbonyl)carbamate, AJ-030/12105504, Carbamic acid, [(6,8-diiodo-2-oxo-2H-1-benzopyran-3-yl)carbonyl]-, ethyl ester, ethyl (6,8-diiodo-2-oxo-2H-chromen-3-yl)carbonylcarbamate
| Molecular Formula | C13H9I2NO5 |
|---|---|
| Molecular Weight | 512.86 g/mol |
| LogP | 2.8885 |
| Topological Polar Surface Area | 85.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 512.857 |
| Heavy Atoms | 21 |
| Complexity | 783.96063 |
Chemical Identifiers
| CAS Number | 353281-19-3 |
|---|---|
| SMILES | CCOC(=O)NC(=O)C1=CC2=CC(=CC(=C2OC1=O)I)I |
Product Overview
(6,8-Diiodo-2-oxo-2h-chromene-3-carbonyl)-carbamic acid ethyl ester (CAS 353281-19-3), with molecular formula C13H9I2NO5 and molecular weight 512.86 g/mol. IUPAC: ethyl N-(6,8-diiodo-2-oxochromene-3-carbonyl)carbamate.
Chemical Property Profile of (6,8-Diiodo-2-oxo-2h-chromene-3-carbonyl)-carbamic acid ethyl ester
Property Insights of (6,8-Diiodo-2-oxo-2h-chromene-3-carbonyl)-carbamic acid ethyl ester
The XLogP value of 2.8885 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (6,8-Diiodo-2-oxo-2h-chromene-3-carbonyl)-carbamic acid ethyl ester. The TPSA of 85.61 Ų falls within the moderate polarity range, balancing permeability and solubility for (6,8-Diiodo-2-oxo-2h-chromene-3-carbonyl)-carbamic acid ethyl ester. Following Lipinski's Rule of Five, (6,8-Diiodo-2-oxo-2h-chromene-3-carbonyl)-carbamic acid ethyl ester has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (6,8-Diiodo-2-oxo-2h-chromene-3-carbonyl)-carbamic acid ethyl ester?
The CAS number of (6,8-Diiodo-2-oxo-2h-chromene-3-carbonyl)-carbamic acid ethyl ester is 353281-19-3.
What is the molecular formula of (6,8-Diiodo-2-oxo-2h-chromene-3-carbonyl)-carbamic acid ethyl ester?
The molecular formula of (6,8-Diiodo-2-oxo-2h-chromene-3-carbonyl)-carbamic acid ethyl ester is C13H9I2NO5.
What is the molecular weight of (6,8-Diiodo-2-oxo-2h-chromene-3-carbonyl)-carbamic acid ethyl ester?
The molecular weight of (6,8-Diiodo-2-oxo-2h-chromene-3-carbonyl)-carbamic acid ethyl ester is 512.86 g/mol.
Where can I buy (6,8-Diiodo-2-oxo-2h-chromene-3-carbonyl)-carbamic acid ethyl ester?
You can request a quote for (6,8-Diiodo-2-oxo-2h-chromene-3-carbonyl)-carbamic acid ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (6,8-Diiodo-2-oxo-2h-chromene-3-carbonyl)-carbamic acid ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for (6,8-Diiodo-2-oxo-2h-chromene-3-carbonyl)-carbamic acid ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.