2-((2-Hydroxy-3,5-diiodophenyl)methylene)propanedinitrile
TL;DR: 2-((2-Hydroxy-3,5-diiodophenyl)methylene)propanedinitrile (CAS 727656-13-5) is a chemical compound with molecular formula C10H4I2N2O and molecular weight 421.84 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2-hydroxy-3,5-diiodophenyl)methylidene]propanedinitrile
Also Known As: 2-[(2-Hydroxy-3,5-diiodophenyl)methylene]propanedinitrile, 2-[(2-hydroxy-3,5-diiodophenyl)methylidene]propanedinitrile, [(2-Hydroxy-3,5-diiodophenyl)methylidene]propanedinitrile, 2-((2-Hydroxy-3,5-diiodophenyl)methylene)propanedinitrile, 2-[(2-hydroxy-3,5-diiodo-phenyl)methylidene]propanedinitrile
| Molecular Formula | C10H4I2N2O |
|---|---|
| Molecular Weight | 421.84 g/mol |
| LogP | 3.03196 |
| Topological Polar Surface Area | 67.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 421.8413 |
| Heavy Atoms | 15 |
| Complexity | 493.37927 |
Chemical Identifiers
| CAS Number | 727656-13-5 |
|---|---|
| SMILES | C1=C(C=C(C(=C1C=C(C#N)C#N)O)I)I |
Product Overview
2-((2-Hydroxy-3,5-diiodophenyl)methylene)propanedinitrile (CAS 727656-13-5), with molecular formula C10H4I2N2O and molecular weight 421.84 g/mol. IUPAC: 2-[(2-hydroxy-3,5-diiodophenyl)methylidene]propanedinitrile.
Chemical Property Profile of 2-((2-Hydroxy-3,5-diiodophenyl)methylene)propanedinitrile
Property Insights of 2-((2-Hydroxy-3,5-diiodophenyl)methylene)propanedinitrile
The XLogP value of 3.03196 indicates that 2-((2-Hydroxy-3,5-diiodophenyl)methylene)propanedinitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.81 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-((2-Hydroxy-3,5-diiodophenyl)methylene)propanedinitrile. Following Lipinski's Rule of Five, 2-((2-Hydroxy-3,5-diiodophenyl)methylene)propanedinitrile 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 2-((2-Hydroxy-3,5-diiodophenyl)methylene)propanedinitrile?
The CAS number of 2-((2-Hydroxy-3,5-diiodophenyl)methylene)propanedinitrile is 727656-13-5.
What is the molecular formula of 2-((2-Hydroxy-3,5-diiodophenyl)methylene)propanedinitrile?
The molecular formula of 2-((2-Hydroxy-3,5-diiodophenyl)methylene)propanedinitrile is C10H4I2N2O.
What is the molecular weight of 2-((2-Hydroxy-3,5-diiodophenyl)methylene)propanedinitrile?
The molecular weight of 2-((2-Hydroxy-3,5-diiodophenyl)methylene)propanedinitrile is 421.84 g/mol.
Where can I buy 2-((2-Hydroxy-3,5-diiodophenyl)methylene)propanedinitrile?
You can request a quote for 2-((2-Hydroxy-3,5-diiodophenyl)methylene)propanedinitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-((2-Hydroxy-3,5-diiodophenyl)methylene)propanedinitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-((2-Hydroxy-3,5-diiodophenyl)methylene)propanedinitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.