4-Chloro-3,5-dimethyl-2-nitrophenol
TL;DR: 4-Chloro-3,5-dimethyl-2-nitrophenol (CAS 6317-52-8) is a chemical compound with molecular formula C8H8ClNO3 and molecular weight 201.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-3,5-dimethyl-2-nitrophenol
Also Known As: 4-chloro-3,5-dimethyl-2-nitrophenol, 2-Nitro-3,5-dimethyl-4-chlorophenol, 4-Chlor-3,5-dimethyl-2-nitro-phenol, AZ0001-0420, J2.736.949I
| Molecular Formula | C8H8ClNO3 |
|---|---|
| Molecular Weight | 201.02 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 66.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 201.01927 |
| Heavy Atoms | 13 |
| Complexity | 206.0 |
Chemical Identifiers
| CAS Number | 6317-52-8 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1Cl)C)[N+](=O)[O-])O |
| InChIKey | YOTFJCRTPIJJFX-UHFFFAOYSA-N |
Product Overview
4-Chloro-3,5-dimethyl-2-nitrophenol (CAS 6317-52-8), with molecular formula C8H8ClNO3 and molecular weight 201.02 g/mol. IUPAC: 4-chloro-3,5-dimethyl-2-nitrophenol.
Chemical Property Profile of 4-Chloro-3,5-dimethyl-2-nitrophenol
Property Insights of 4-Chloro-3,5-dimethyl-2-nitrophenol
The XLogP value of 3.3 indicates that 4-Chloro-3,5-dimethyl-2-nitrophenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Chloro-3,5-dimethyl-2-nitrophenol. Following Lipinski's Rule of Five, 4-Chloro-3,5-dimethyl-2-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 4-Chloro-3,5-dimethyl-2-nitrophenol?
The CAS number of 4-Chloro-3,5-dimethyl-2-nitrophenol is 6317-52-8.
What is the molecular formula of 4-Chloro-3,5-dimethyl-2-nitrophenol?
The molecular formula of 4-Chloro-3,5-dimethyl-2-nitrophenol is C8H8ClNO3.
What is the molecular weight of 4-Chloro-3,5-dimethyl-2-nitrophenol?
The molecular weight of 4-Chloro-3,5-dimethyl-2-nitrophenol is 201.02 g/mol.
Where can I buy 4-Chloro-3,5-dimethyl-2-nitrophenol?
You can request a quote for 4-Chloro-3,5-dimethyl-2-nitrophenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Chloro-3,5-dimethyl-2-nitrophenol?
Yes, KEHONG BIO provides custom synthesis services for 4-Chloro-3,5-dimethyl-2-nitrophenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.