2,6-Bis(chloromethyl)-4-nitrophenol
TL;DR: 2,6-Bis(chloromethyl)-4-nitrophenol (CAS 27694-52-6) is a chemical compound with molecular formula C8H7Cl2NO3 and molecular weight 234.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,6-bis(chloromethyl)-4-nitrophenol
Also Known As: 2,6-bis(chloromethyl)-4-nitrophenol, 2,6-bis(chloromethyl)-4-nitro-phenol
| Molecular Formula | C8H7Cl2NO3 |
|---|---|
| Molecular Weight | 234.98 g/mol |
| LogP | 2.778 |
| Topological Polar Surface Area | 63.37 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 234.9803 |
| Heavy Atoms | 14 |
| Complexity | 342.59918 |
Chemical Identifiers
| CAS Number | 27694-52-6 |
|---|---|
| SMILES | C1=C(C=C(C(=C1CCl)O)CCl)[N+](=O)[O-] |
Product Overview
2,6-Bis(chloromethyl)-4-nitrophenol (CAS 27694-52-6), with molecular formula C8H7Cl2NO3 and molecular weight 234.98 g/mol. IUPAC: 2,6-bis(chloromethyl)-4-nitrophenol.
Chemical Property Profile of 2,6-Bis(chloromethyl)-4-nitrophenol
Property Insights of 2,6-Bis(chloromethyl)-4-nitrophenol
The XLogP value of 2.778 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,6-Bis(chloromethyl)-4-nitrophenol. The TPSA of 63.37 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,6-Bis(chloromethyl)-4-nitrophenol. Following Lipinski's Rule of Five, 2,6-Bis(chloromethyl)-4-nitrophenol 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 2,6-Bis(chloromethyl)-4-nitrophenol?
The CAS number of 2,6-Bis(chloromethyl)-4-nitrophenol is 27694-52-6.
What is the molecular formula of 2,6-Bis(chloromethyl)-4-nitrophenol?
The molecular formula of 2,6-Bis(chloromethyl)-4-nitrophenol is C8H7Cl2NO3.
What is the molecular weight of 2,6-Bis(chloromethyl)-4-nitrophenol?
The molecular weight of 2,6-Bis(chloromethyl)-4-nitrophenol is 234.98 g/mol.
Where can I buy 2,6-Bis(chloromethyl)-4-nitrophenol?
You can request a quote for 2,6-Bis(chloromethyl)-4-nitrophenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,6-Bis(chloromethyl)-4-nitrophenol?
Yes, KEHONG BIO provides custom synthesis services for 2,6-Bis(chloromethyl)-4-nitrophenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.