1-[2-[Chloro-[2-(4-nitrophenyl)ethoxy]phosphoryl]oxyethyl]-4-nitrobenzene
TL;DR: 1-[2-[Chloro-[2-(4-nitrophenyl)ethoxy]phosphoryl]oxyethyl]-4-nitrobenzene (CAS 85363-77-5) is a chemical compound with molecular formula C16H16ClN2O7P and molecular weight 414.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-[chloro-[2-(4-nitrophenyl)ethoxy]phosphoryl]oxyethyl]-4-nitrobenzene
Also Known As: Bis[2-(P-nitrophenyl)ethyl]phosphorochloridate, bis(p-nitrophenethyl)phosphorochloridate, 1-[2-[chloro-[2-(4-nitrophenyl)ethoxy]phosphoryl]oxyethyl]-4-nitrobenzene, BIS[2-(P-NITROPHENYL)ETHYL] PHOSPHOROCHLORIDATE, 1-[2-[chloro-[2-(4-nitrophenyl)ethoxy]phosphoryl]oxyethyl]-4-nitro-benzene
| Molecular Formula | C16H16ClN2O7P |
|---|---|
| Molecular Weight | 414.04 g/mol |
| LogP | 4.6683 |
| Topological Polar Surface Area | 121.81 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 10 |
| Exact Mass | 414.03836 |
| Heavy Atoms | 27 |
| Complexity | 775.35223 |
Chemical Identifiers
| CAS Number | 85363-77-5 |
|---|---|
| SMILES | C1=CC(=CC=C1CCOP(=O)(OCCC2=CC=C(C=C2)[N+](=O)[O-])Cl)[N+](=O)[O-] |
Product Overview
1-[2-[Chloro-[2-(4-nitrophenyl)ethoxy]phosphoryl]oxyethyl]-4-nitrobenzene (CAS 85363-77-5), with molecular formula C16H16ClN2O7P and molecular weight 414.04 g/mol. IUPAC: 1-[2-[chloro-[2-(4-nitrophenyl)ethoxy]phosphoryl]oxyethyl]-4-nitrobenzene.
Chemical Property Profile of 1-[2-[Chloro-[2-(4-nitrophenyl)ethoxy]phosphoryl]oxyethyl]-4-nitrobenzene
Property Insights of 1-[2-[Chloro-[2-(4-nitrophenyl)ethoxy]phosphoryl]oxyethyl]-4-nitrobenzene
The XLogP value of 4.6683 indicates that 1-[2-[Chloro-[2-(4-nitrophenyl)ethoxy]phosphoryl]oxyethyl]-4-nitrobenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 121.81 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[2-[Chloro-[2-(4-nitrophenyl)ethoxy]phosphoryl]oxyethyl]-4-nitrobenzene. Following Lipinski's Rule of Five, 1-[2-[Chloro-[2-(4-nitrophenyl)ethoxy]phosphoryl]oxyethyl]-4-nitrobenzene has 0 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 1-[2-[Chloro-[2-(4-nitrophenyl)ethoxy]phosphoryl]oxyethyl]-4-nitrobenzene?
The CAS number of 1-[2-[Chloro-[2-(4-nitrophenyl)ethoxy]phosphoryl]oxyethyl]-4-nitrobenzene is 85363-77-5.
What is the molecular formula of 1-[2-[Chloro-[2-(4-nitrophenyl)ethoxy]phosphoryl]oxyethyl]-4-nitrobenzene?
The molecular formula of 1-[2-[Chloro-[2-(4-nitrophenyl)ethoxy]phosphoryl]oxyethyl]-4-nitrobenzene is C16H16ClN2O7P.
What is the molecular weight of 1-[2-[Chloro-[2-(4-nitrophenyl)ethoxy]phosphoryl]oxyethyl]-4-nitrobenzene?
The molecular weight of 1-[2-[Chloro-[2-(4-nitrophenyl)ethoxy]phosphoryl]oxyethyl]-4-nitrobenzene is 414.04 g/mol.
Where can I buy 1-[2-[Chloro-[2-(4-nitrophenyl)ethoxy]phosphoryl]oxyethyl]-4-nitrobenzene?
You can request a quote for 1-[2-[Chloro-[2-(4-nitrophenyl)ethoxy]phosphoryl]oxyethyl]-4-nitrobenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[2-[Chloro-[2-(4-nitrophenyl)ethoxy]phosphoryl]oxyethyl]-4-nitrobenzene?
Yes, KEHONG BIO provides custom synthesis services for 1-[2-[Chloro-[2-(4-nitrophenyl)ethoxy]phosphoryl]oxyethyl]-4-nitrobenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.