2-Bromo-4-chloro-6-nitrophenol
TL;DR: 2-Bromo-4-chloro-6-nitrophenol (CAS 20294-55-7) is a chemical compound with molecular formula C6H3BrClNO3 and molecular weight 250.90 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-bromo-4-chloro-6-nitrophenol
Also Known As: 2-bromo-4-chloro-6-nitrophenol, 2-bromo-4-chloro-6-nitro-phenol, Phenol, 2-bromo-4-chloro-6-nitro-, 2-nitro-4-chloro-6-bromophenol, Phenol,2-bromo-4-chloro-6-nitro-
| Molecular Formula | C6H3BrClNO3 |
|---|---|
| Molecular Weight | 250.90 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 66.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 250.89848 |
| Heavy Atoms | 12 |
| Complexity | 186.0 |
Chemical Identifiers
| CAS Number | 20294-55-7 |
|---|---|
| SMILES | C1=C(C=C(C(=C1[N+](=O)[O-])O)Br)Cl |
| InChIKey | POBOBTAMSJHELX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Bromo-4-chloro-6-nitrophenol (CAS 20294-55-7), with molecular formula C6H3BrClNO3 and molecular weight 250.90 g/mol. IUPAC: 2-bromo-4-chloro-6-nitrophenol.
Chemical Property Profile of 2-Bromo-4-chloro-6-nitrophenol
Property Insights of 2-Bromo-4-chloro-6-nitrophenol
The XLogP value of 4.1 indicates that 2-Bromo-4-chloro-6-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 2-Bromo-4-chloro-6-nitrophenol. Following Lipinski's Rule of Five, 2-Bromo-4-chloro-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-Bromo-4-chloro-6-nitrophenol?
The CAS number of 2-Bromo-4-chloro-6-nitrophenol is 20294-55-7.
What is the molecular formula of 2-Bromo-4-chloro-6-nitrophenol?
The molecular formula of 2-Bromo-4-chloro-6-nitrophenol is C6H3BrClNO3.
What is the molecular weight of 2-Bromo-4-chloro-6-nitrophenol?
The molecular weight of 2-Bromo-4-chloro-6-nitrophenol is 250.90 g/mol.
Where can I buy 2-Bromo-4-chloro-6-nitrophenol?
You can request a quote for 2-Bromo-4-chloro-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-Bromo-4-chloro-6-nitrophenol?
Yes, KEHONG BIO provides custom synthesis services for 2-Bromo-4-chloro-6-nitrophenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.