![3-[2-Chloro-4-(trifluoromethyl)phenoxy]-4-nitrophenol structure](/static/products/3097/309727-46-6.webp)
3-[2-Chloro-4-(trifluoromethyl)phenoxy]-4-nitrophenol
TL;DR: 3-[2-Chloro-4-(trifluoromethyl)phenoxy]-4-nitrophenol (CAS 309727-46-6) is a chemical compound with molecular formula C13H7ClF3NO4 and molecular weight 333.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[2-chloro-4-(trifluoromethyl)phenoxy]-4-nitrophenol
Also Known As: 3-[2-Chloro-4-(trifluoromethyl)phenoxy]-4-nitrophenol, ZERO/001466, 3-(2-Chloro-4-(trifluoromethyl)phenoxy)-4-nitrophenol, Phenol, 3-(2-chloro-4-trifluoromethylphenoxy)-4-nitro-, 3-(2-Chloro-4-trifluoromethyl-phenoxy)-4-nitro-phenol
| Molecular Formula | C13H7ClF3NO4 |
|---|---|
| Molecular Weight | 333.00 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 75.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 333.00156 |
| Heavy Atoms | 22 |
| Complexity | 404.0 |
Chemical Identifiers
| CAS Number | 309727-46-6 |
|---|---|
| SMILES | C1=CC(=C(C=C1C(F)(F)F)Cl)OC2=C(C=CC(=C2)O)[N+](=O)[O-] |
| InChIKey | KBDFDHPBOBHNMN-UHFFFAOYSA-N |
Product Overview
3-[2-Chloro-4-(trifluoromethyl)phenoxy]-4-nitrophenol (CAS 309727-46-6), with molecular formula C13H7ClF3NO4 and molecular weight 333.00 g/mol. IUPAC: 3-[2-chloro-4-(trifluoromethyl)phenoxy]-4-nitrophenol.
Chemical Property Profile of 3-[2-Chloro-4-(trifluoromethyl)phenoxy]-4-nitrophenol
Property Insights of 3-[2-Chloro-4-(trifluoromethyl)phenoxy]-4-nitrophenol
The XLogP value of 4.0 indicates that 3-[2-Chloro-4-(trifluoromethyl)phenoxy]-4-nitrophenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[2-Chloro-4-(trifluoromethyl)phenoxy]-4-nitrophenol. Following Lipinski's Rule of Five, 3-[2-Chloro-4-(trifluoromethyl)phenoxy]-4-nitrophenol has 1 hydrogen bond donor(s) and 7 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 3-[2-Chloro-4-(trifluoromethyl)phenoxy]-4-nitrophenol?
The CAS number of 3-[2-Chloro-4-(trifluoromethyl)phenoxy]-4-nitrophenol is 309727-46-6.
What is the molecular formula of 3-[2-Chloro-4-(trifluoromethyl)phenoxy]-4-nitrophenol?
The molecular formula of 3-[2-Chloro-4-(trifluoromethyl)phenoxy]-4-nitrophenol is C13H7ClF3NO4.
What is the molecular weight of 3-[2-Chloro-4-(trifluoromethyl)phenoxy]-4-nitrophenol?
The molecular weight of 3-[2-Chloro-4-(trifluoromethyl)phenoxy]-4-nitrophenol is 333.00 g/mol.
Where can I buy 3-[2-Chloro-4-(trifluoromethyl)phenoxy]-4-nitrophenol?
You can request a quote for 3-[2-Chloro-4-(trifluoromethyl)phenoxy]-4-nitrophenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[2-Chloro-4-(trifluoromethyl)phenoxy]-4-nitrophenol?
Yes, KEHONG BIO provides custom synthesis services for 3-[2-Chloro-4-(trifluoromethyl)phenoxy]-4-nitrophenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.