![2-[(4-Hydroxy-3-iodo-5-methoxyphenyl)methylene]malononitrile structure](/static/products/2738/27389-84-0.webp)
2-[(4-Hydroxy-3-iodo-5-methoxyphenyl)methylene]malononitrile
TL;DR: 2-[(4-Hydroxy-3-iodo-5-methoxyphenyl)methylene]malononitrile (CAS 27389-84-0) is a chemical compound with molecular formula C11H7IN2O2 and molecular weight 325.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-hydroxy-3-iodo-5-methoxyphenyl)methylidene]propanedinitrile
Also Known As: 2-[(4-Hydroxy-3-iodo-5-methoxyphenyl)methylene]malononitrile, 2-(4-Hydroxy-3-iodo-5-methoxybenzylidene)malononitrile, 2-[(4-hydroxy-3-iodo-5-methoxyphenyl)methylidene]propanedinitrile, 3-methoxy-4-hydroxy-5-iodobenzylidene malononitrile, (4-hydroxy-3-iodo-5-methoxybenzylidene)propanedinitrile
| Molecular Formula | C11H7IN2O2 |
|---|---|
| Molecular Weight | 325.96 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 77.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 325.95523 |
| Heavy Atoms | 16 |
| Complexity | 358.0 |
Chemical Identifiers
| CAS Number | 27389-84-0 |
|---|---|
| SMILES | COC1=C(C(=CC(=C1)C=C(C#N)C#N)I)O |
| InChIKey | BZIXGOBJBFWPTF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-[(4-Hydroxy-3-iodo-5-methoxyphenyl)methylene]malononitrile (CAS 27389-84-0), with molecular formula C11H7IN2O2 and molecular weight 325.96 g/mol. IUPAC: 2-[(4-hydroxy-3-iodo-5-methoxyphenyl)methylidene]propanedinitrile.
Chemical Property Profile of 2-[(4-Hydroxy-3-iodo-5-methoxyphenyl)methylene]malononitrile
Property Insights of 2-[(4-Hydroxy-3-iodo-5-methoxyphenyl)methylene]malononitrile
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(4-Hydroxy-3-iodo-5-methoxyphenyl)methylene]malononitrile. The TPSA of 77.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(4-Hydroxy-3-iodo-5-methoxyphenyl)methylene]malononitrile. Following Lipinski's Rule of Five, 2-[(4-Hydroxy-3-iodo-5-methoxyphenyl)methylene]malononitrile has 1 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 2-[(4-Hydroxy-3-iodo-5-methoxyphenyl)methylene]malononitrile?
The CAS number of 2-[(4-Hydroxy-3-iodo-5-methoxyphenyl)methylene]malononitrile is 27389-84-0.
What is the molecular formula of 2-[(4-Hydroxy-3-iodo-5-methoxyphenyl)methylene]malononitrile?
The molecular formula of 2-[(4-Hydroxy-3-iodo-5-methoxyphenyl)methylene]malononitrile is C11H7IN2O2.
What is the molecular weight of 2-[(4-Hydroxy-3-iodo-5-methoxyphenyl)methylene]malononitrile?
The molecular weight of 2-[(4-Hydroxy-3-iodo-5-methoxyphenyl)methylene]malononitrile is 325.96 g/mol.
Where can I buy 2-[(4-Hydroxy-3-iodo-5-methoxyphenyl)methylene]malononitrile?
You can request a quote for 2-[(4-Hydroxy-3-iodo-5-methoxyphenyl)methylene]malononitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(4-Hydroxy-3-iodo-5-methoxyphenyl)methylene]malononitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-[(4-Hydroxy-3-iodo-5-methoxyphenyl)methylene]malononitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.