4-Nitrophenyl (4-methoxyphenyl)methylphosphinate
TL;DR: 4-Nitrophenyl (4-methoxyphenyl)methylphosphinate (CAS 81349-01-1) is a chemical compound with molecular formula C14H14NO5P and molecular weight 307.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(4-methoxyphenyl)-methylphosphoryl]oxy-4-nitrobenzene
Also Known As: 4-Nitrophenyl (4-methoxyphenyl)methylphosphinate, 4-Nitrophenyl (4-methoxyphenyl)(methyl)phosphinate, 1-[(4-methoxyphenyl)-methylphosphoryl]oxy-4-nitrobenzene, Phosphinic acid, (4-methoxyphenyl)methyl-, 4-nitrophenyl ester
| Molecular Formula | C14H14NO5P |
|---|---|
| Molecular Weight | 307.06 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 81.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 307.06097 |
| Heavy Atoms | 21 |
| Complexity | 395.0 |
Chemical Identifiers
| CAS Number | 81349-01-1 |
|---|---|
| SMILES | COC1=CC=C(C=C1)P(=O)(C)OC2=CC=C(C=C2)[N+](=O)[O-] |
| InChIKey | SEDGVEDGMFGPHD-UHFFFAOYSA-N |
Product Overview
4-Nitrophenyl (4-methoxyphenyl)methylphosphinate (CAS 81349-01-1), with molecular formula C14H14NO5P and molecular weight 307.06 g/mol. IUPAC: 1-[(4-methoxyphenyl)-methylphosphoryl]oxy-4-nitrobenzene.
Chemical Property Profile of 4-Nitrophenyl (4-methoxyphenyl)methylphosphinate
Property Insights of 4-Nitrophenyl (4-methoxyphenyl)methylphosphinate
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Nitrophenyl (4-methoxyphenyl)methylphosphinate. The TPSA of 81.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Nitrophenyl (4-methoxyphenyl)methylphosphinate. Following Lipinski's Rule of Five, 4-Nitrophenyl (4-methoxyphenyl)methylphosphinate 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 4-Nitrophenyl (4-methoxyphenyl)methylphosphinate?
The CAS number of 4-Nitrophenyl (4-methoxyphenyl)methylphosphinate is 81349-01-1.
What is the molecular formula of 4-Nitrophenyl (4-methoxyphenyl)methylphosphinate?
The molecular formula of 4-Nitrophenyl (4-methoxyphenyl)methylphosphinate is C14H14NO5P.
What is the molecular weight of 4-Nitrophenyl (4-methoxyphenyl)methylphosphinate?
The molecular weight of 4-Nitrophenyl (4-methoxyphenyl)methylphosphinate is 307.06 g/mol.
Where can I buy 4-Nitrophenyl (4-methoxyphenyl)methylphosphinate?
You can request a quote for 4-Nitrophenyl (4-methoxyphenyl)methylphosphinate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Nitrophenyl (4-methoxyphenyl)methylphosphinate?
Yes, KEHONG BIO provides custom synthesis services for 4-Nitrophenyl (4-methoxyphenyl)methylphosphinate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.