4-Hydroxyimino-3-iodo-2,5-cyclohexadiene-1-one
TL;DR: 4-Hydroxyimino-3-iodo-2,5-cyclohexadiene-1-one (CAS 39495-50-6) is a chemical compound with molecular formula C6H4INO2 and molecular weight 248.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-iodo-4-nitrosophenol
Also Known As: 3-iodo-4-nitrosophenol, 3-iodo-4-nitroso-phenol, 2, 4-hydroxyimino-3-iodo-, iodo-[1,4]benzoquinone-1-oxime, 2,4-dione, 2-iodo-, 1-oxime
| Molecular Formula | C6H4INO2 |
|---|---|
| Molecular Weight | 248.93 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 49.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 248.92868 |
| Heavy Atoms | 10 |
| Complexity | 131.0 |
Chemical Identifiers
| CAS Number | 39495-50-6 |
|---|---|
| SMILES | C1=CC(=C(C=C1O)I)N=O |
| InChIKey | CCAMOKMWECRXDF-UHFFFAOYSA-N |
Product Overview
4-Hydroxyimino-3-iodo-2,5-cyclohexadiene-1-one (CAS 39495-50-6), with molecular formula C6H4INO2 and molecular weight 248.93 g/mol. IUPAC: 3-iodo-4-nitrosophenol.
Chemical Property Profile of 4-Hydroxyimino-3-iodo-2,5-cyclohexadiene-1-one
Property Insights of 4-Hydroxyimino-3-iodo-2,5-cyclohexadiene-1-one
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Hydroxyimino-3-iodo-2,5-cyclohexadiene-1-one. With a topological polar surface area (TPSA) of 49.7 Ų, 4-Hydroxyimino-3-iodo-2,5-cyclohexadiene-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Hydroxyimino-3-iodo-2,5-cyclohexadiene-1-one has 1 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 4-Hydroxyimino-3-iodo-2,5-cyclohexadiene-1-one?
The CAS number of 4-Hydroxyimino-3-iodo-2,5-cyclohexadiene-1-one is 39495-50-6.
What is the molecular formula of 4-Hydroxyimino-3-iodo-2,5-cyclohexadiene-1-one?
The molecular formula of 4-Hydroxyimino-3-iodo-2,5-cyclohexadiene-1-one is C6H4INO2.
What is the molecular weight of 4-Hydroxyimino-3-iodo-2,5-cyclohexadiene-1-one?
The molecular weight of 4-Hydroxyimino-3-iodo-2,5-cyclohexadiene-1-one is 248.93 g/mol.
Where can I buy 4-Hydroxyimino-3-iodo-2,5-cyclohexadiene-1-one?
You can request a quote for 4-Hydroxyimino-3-iodo-2,5-cyclohexadiene-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Hydroxyimino-3-iodo-2,5-cyclohexadiene-1-one?
Yes, KEHONG BIO provides custom synthesis services for 4-Hydroxyimino-3-iodo-2,5-cyclohexadiene-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.