2,4-Dichloro-3,5-dimethyl-6-nitrophenol
TL;DR: 2,4-Dichloro-3,5-dimethyl-6-nitrophenol (CAS 70444-49-4) 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.
2,4-dichloro-3,5-dimethyl-6-nitrophenol
Also Known As: 2,4-dichloro-3,5-dimethyl-6-nitrophenol, 3-Benzyladenine, 2,4-dichloro-3,5-dimethyl-6-nitro-phenol, 2,4-bis(chloranyl)-3,5-dimethyl-6-nitro-phenol
| Molecular Formula | C8H7Cl2NO3 |
|---|---|
| Molecular Weight | 234.98 g/mol |
| LogP | 3.22404 |
| Topological Polar Surface Area | 63.37 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 234.9803 |
| Heavy Atoms | 14 |
| Complexity | 388.5328 |
Chemical Identifiers
| CAS Number | 70444-49-4 |
|---|---|
| SMILES | CC1=C(C(=C(C(=C1Cl)C)Cl)O)[N+](=O)[O-] |
Product Overview
2,4-Dichloro-3,5-dimethyl-6-nitrophenol (CAS 70444-49-4), with molecular formula C8H7Cl2NO3 and molecular weight 234.98 g/mol. IUPAC: 2,4-dichloro-3,5-dimethyl-6-nitrophenol.
Chemical Property Profile of 2,4-Dichloro-3,5-dimethyl-6-nitrophenol
Property Insights of 2,4-Dichloro-3,5-dimethyl-6-nitrophenol
The XLogP value of 3.22404 indicates that 2,4-Dichloro-3,5-dimethyl-6-nitrophenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.37 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,4-Dichloro-3,5-dimethyl-6-nitrophenol. Following Lipinski's Rule of Five, 2,4-Dichloro-3,5-dimethyl-6-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 2,4-Dichloro-3,5-dimethyl-6-nitrophenol?
The CAS number of 2,4-Dichloro-3,5-dimethyl-6-nitrophenol is 70444-49-4.
What is the molecular formula of 2,4-Dichloro-3,5-dimethyl-6-nitrophenol?
The molecular formula of 2,4-Dichloro-3,5-dimethyl-6-nitrophenol is C8H7Cl2NO3.
What is the molecular weight of 2,4-Dichloro-3,5-dimethyl-6-nitrophenol?
The molecular weight of 2,4-Dichloro-3,5-dimethyl-6-nitrophenol is 234.98 g/mol.
Where can I buy 2,4-Dichloro-3,5-dimethyl-6-nitrophenol?
You can request a quote for 2,4-Dichloro-3,5-dimethyl-6-nitrophenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4-Dichloro-3,5-dimethyl-6-nitrophenol?
Yes, KEHONG BIO provides custom synthesis services for 2,4-Dichloro-3,5-dimethyl-6-nitrophenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.