4-Chloro-2,6-dinitrophenol
TL;DR: 4-Chloro-2,6-dinitrophenol (CAS 88-87-9) is a chemical compound with molecular formula C6H3ClN2O5 and molecular weight 217.97305 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-chloro-2,6-dinitrophenol
Also Known As: 4-CHLORO-2,6-DINITROPHENOL, 2,6-Dinitro-4-chlorophenol, Phenol,6-dinitro-, Phenol, 4-chloro-2,6-dinitro-, Phenol,4-chloro-2,6-dinitro-
Application Areas
Top 5 of 6 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C6H3ClN2O5 |
| Molecular Weight | 217.97305 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 112.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 217.97305 Da |
| Heavy Atoms | 14 |
| Complexity | 226.0 |
| SMILES | C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])Cl |
| InChIKey | KESYALTWUAFAAC-UHFFFAOYSA-N |
Product Description
Applications: 4-Chloro-2,6-dinitrophenol is used in complex organic molecule assembly across discovery and process chemistry, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
4-Chloro-2,6-dinitrophenol (CAS 88-87-9) is a organic building block with the molecular formula C6H3ClN2O5 and a molecular weight of 217.97 g/mol. Synonyms include 4-CHLORO-2,6-DINITROPHENOL and 2,6-Dinitro-4-chlorophenol.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of 4-Chloro-2,6-dinitrophenol
Property Insights of 4-Chloro-2,6-dinitrophenol
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Chloro-2,6-dinitrophenol. The TPSA of 112.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Chloro-2,6-dinitrophenol. Following Lipinski's Rule of Five, 4-Chloro-2,6-dinitrophenol has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-Chloro-2,6-dinitrophenol?
The CAS number of 4-Chloro-2,6-dinitrophenol is 88-87-9.
What is the molecular formula of 4-Chloro-2,6-dinitrophenol?
The molecular formula of 4-Chloro-2,6-dinitrophenol is C6H3ClN2O5.
What is the molecular weight of 4-Chloro-2,6-dinitrophenol?
The molecular weight of 4-Chloro-2,6-dinitrophenol is 217.97305 g/mol.
What are the applications of 4-Chloro-2,6-dinitrophenol?
4-Chloro-2,6-dinitrophenol is used in complex organic molecule assembly across discovery and process chemistry, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and...
Where can I buy 4-Chloro-2,6-dinitrophenol?
You can request a quote for 4-Chloro-2,6-dinitrophenol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-Chloro-2,6-dinitrophenol?
Yes, CoreyChem provides custom synthesis services for 4-Chloro-2,6-dinitrophenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.