1-(Methoxyphenylphosphoryl)oxy-4-nitrobenzene
TL;DR: 1-(Methoxyphenylphosphoryl)oxy-4-nitrobenzene (CAS 18275-76-8) is a chemical compound with molecular formula C13H12NO5P and molecular weight 293.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[methoxy(phenyl)phosphoryl]oxy-4-nitrobenzene
Also Known As: methyl 4-nitrophenyl phenylphosphonate, 1-(Methoxyphenylphosphoryl)oxy-4-nitrobenzene, 1-[methoxy(phenyl)phosphoryl]oxy-4-nitrobenzene, Phenylphosphonic acid methyl 4-nitrophenyl ester, Phenylphosphonic acid methyl(4-nitrophenyl) ester
| Molecular Formula | C13H12NO5P |
|---|---|
| Molecular Weight | 293.05 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 81.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 293.04532 |
| Heavy Atoms | 20 |
| Complexity | 369.0 |
Chemical Identifiers
| CAS Number | 18275-76-8 |
|---|---|
| SMILES | COP(=O)(C1=CC=CC=C1)OC2=CC=C(C=C2)[N+](=O)[O-] |
| InChIKey | DGBAYRAIRQEPLX-UHFFFAOYSA-N |
Product Overview
1-(Methoxyphenylphosphoryl)oxy-4-nitrobenzene (CAS 18275-76-8), with molecular formula C13H12NO5P and molecular weight 293.05 g/mol. IUPAC: 1-[methoxy(phenyl)phosphoryl]oxy-4-nitrobenzene.
Chemical Property Profile of 1-(Methoxyphenylphosphoryl)oxy-4-nitrobenzene
Property Insights of 1-(Methoxyphenylphosphoryl)oxy-4-nitrobenzene
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(Methoxyphenylphosphoryl)oxy-4-nitrobenzene. The TPSA of 81.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(Methoxyphenylphosphoryl)oxy-4-nitrobenzene. Following Lipinski's Rule of Five, 1-(Methoxyphenylphosphoryl)oxy-4-nitrobenzene has 0 hydrogen bond donor(s) and 5 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-(Methoxyphenylphosphoryl)oxy-4-nitrobenzene?
The CAS number of 1-(Methoxyphenylphosphoryl)oxy-4-nitrobenzene is 18275-76-8.
What is the molecular formula of 1-(Methoxyphenylphosphoryl)oxy-4-nitrobenzene?
The molecular formula of 1-(Methoxyphenylphosphoryl)oxy-4-nitrobenzene is C13H12NO5P.
What is the molecular weight of 1-(Methoxyphenylphosphoryl)oxy-4-nitrobenzene?
The molecular weight of 1-(Methoxyphenylphosphoryl)oxy-4-nitrobenzene is 293.05 g/mol.
Where can I buy 1-(Methoxyphenylphosphoryl)oxy-4-nitrobenzene?
You can request a quote for 1-(Methoxyphenylphosphoryl)oxy-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-(Methoxyphenylphosphoryl)oxy-4-nitrobenzene?
Yes, KEHONG BIO provides custom synthesis services for 1-(Methoxyphenylphosphoryl)oxy-4-nitrobenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.