(3,5-Dichloro-4-hydroxybenzylidene)propanedinitrile
TL;DR: (3,5-Dichloro-4-hydroxybenzylidene)propanedinitrile (CAS 135274-81-6) is a chemical compound with molecular formula C10H4Cl2N2O and molecular weight 237.97006 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[(3,5-dichloro-4-hydroxyphenyl)methylidene]propanedinitrile
Also Known As: 2,6-dichloro-4-dicyanovinylphenol, (3,5-dichloro-4-hydroxybenzylidene)propanedinitrile, 2,6-Dichloro-4-(2,2-dicyanovinyl)phenol, 2,6-Dichloro-4-(2,2-dicyanoethenyl)phenol, 2-[(3,5-dichloro-4-hydroxyphenyl)methylidene]propanedinitrile
Technical Specifications
| Molecular Formula | C10H4Cl2N2O |
| Molecular Weight | 237.97006 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 67.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 237.97006 Da |
| Heavy Atoms | 15 |
| Complexity | 332.0 |
| SMILES | C1=C(C=C(C(=C1Cl)O)Cl)C=C(C#N)C#N |
| InChIKey | VRFUIEKRFCDQED-UHFFFAOYSA-N |
Chemical Property Profile of (3,5-Dichloro-4-hydroxybenzylidene)propanedinitrile
Property Insights of (3,5-Dichloro-4-hydroxybenzylidene)propanedinitrile
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3,5-Dichloro-4-hydroxybenzylidene)propanedinitrile. The TPSA of 67.8 Ų falls within the moderate polarity range, balancing permeability and solubility for (3,5-Dichloro-4-hydroxybenzylidene)propanedinitrile. Following Lipinski's Rule of Five, (3,5-Dichloro-4-hydroxybenzylidene)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
What is the CAS number of (3,5-Dichloro-4-hydroxybenzylidene)propanedinitrile?
The CAS number of (3,5-Dichloro-4-hydroxybenzylidene)propanedinitrile is 135274-81-6.
What is the molecular formula of (3,5-Dichloro-4-hydroxybenzylidene)propanedinitrile?
The molecular formula of (3,5-Dichloro-4-hydroxybenzylidene)propanedinitrile is C10H4Cl2N2O.
What is the molecular weight of (3,5-Dichloro-4-hydroxybenzylidene)propanedinitrile?
The molecular weight of (3,5-Dichloro-4-hydroxybenzylidene)propanedinitrile is 237.97006 g/mol.
Where can I buy (3,5-Dichloro-4-hydroxybenzylidene)propanedinitrile?
You can request a quote for (3,5-Dichloro-4-hydroxybenzylidene)propanedinitrile directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (3,5-Dichloro-4-hydroxybenzylidene)propanedinitrile?
Yes, CoreyChem provides custom synthesis services for (3,5-Dichloro-4-hydroxybenzylidene)propanedinitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.