1-Chloro-5-ethoxy-4-nitro-2-propoxybenzene
TL;DR: 1-Chloro-5-ethoxy-4-nitro-2-propoxybenzene (CAS 196804-02-1) is a chemical compound with molecular formula C11H14ClNO4 and molecular weight 259.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-chloro-5-ethoxy-4-nitro-2-propoxybenzene
Also Known As: 1-chloro-5-ethoxy-4-nitro-2-propoxybenzene
| Molecular Formula | C11H14ClNO4 |
|---|---|
| Molecular Weight | 259.06 g/mol |
| LogP | 3.4357 |
| Topological Polar Surface Area | 61.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 259.06113 |
| Heavy Atoms | 17 |
| Complexity | 408.70306 |
Chemical Identifiers
| CAS Number | 196804-02-1 |
|---|---|
| SMILES | CCCOC1=C(C=C(C(=C1)[N+](=O)[O-])OCC)Cl |
Product Overview
1-Chloro-5-ethoxy-4-nitro-2-propoxybenzene (CAS 196804-02-1), with molecular formula C11H14ClNO4 and molecular weight 259.06 g/mol. IUPAC: 1-chloro-5-ethoxy-4-nitro-2-propoxybenzene.
Chemical Property Profile of 1-Chloro-5-ethoxy-4-nitro-2-propoxybenzene
Property Insights of 1-Chloro-5-ethoxy-4-nitro-2-propoxybenzene
The XLogP value of 3.4357 indicates that 1-Chloro-5-ethoxy-4-nitro-2-propoxybenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Chloro-5-ethoxy-4-nitro-2-propoxybenzene. Following Lipinski's Rule of Five, 1-Chloro-5-ethoxy-4-nitro-2-propoxybenzene has 0 hydrogen bond donor(s) and 4 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 1-Chloro-5-ethoxy-4-nitro-2-propoxybenzene?
The CAS number of 1-Chloro-5-ethoxy-4-nitro-2-propoxybenzene is 196804-02-1.
What is the molecular formula of 1-Chloro-5-ethoxy-4-nitro-2-propoxybenzene?
The molecular formula of 1-Chloro-5-ethoxy-4-nitro-2-propoxybenzene is C11H14ClNO4.
What is the molecular weight of 1-Chloro-5-ethoxy-4-nitro-2-propoxybenzene?
The molecular weight of 1-Chloro-5-ethoxy-4-nitro-2-propoxybenzene is 259.06 g/mol.
Where can I buy 1-Chloro-5-ethoxy-4-nitro-2-propoxybenzene?
You can request a quote for 1-Chloro-5-ethoxy-4-nitro-2-propoxybenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Chloro-5-ethoxy-4-nitro-2-propoxybenzene?
Yes, KEHONG BIO provides custom synthesis services for 1-Chloro-5-ethoxy-4-nitro-2-propoxybenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.