3-Nitrophenyl dibutylphosphinate
TL;DR: 3-Nitrophenyl dibutylphosphinate (CAS 74038-27-0) is a chemical compound with molecular formula C14H22NO4P and molecular weight 299.12863 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-dibutylphosphoryloxy-3-nitrobenzene
Also Known As: 3-Nitrophenyl dibutylphosphinate, 1-dibutylphosphoryloxy-3-nitrobenzene, Dibutylphosphinic acid m-nitrophenyl ester, Phosphinic acid, dibutyl-, m-nitrophenyl ester, Phosphinic acid, m-nitrophenyl ester
Technical Specifications
| Molecular Formula | C14H22NO4P |
| Molecular Weight | 299.12863 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 72.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 299.12863 Da |
| Heavy Atoms | 20 |
| Complexity | 331.0 |
| SMILES | CCCCP(=O)(CCCC)OC1=CC=CC(=C1)[N+](=O)[O-] |
| InChIKey | LGUBTNHKGWEBEA-UHFFFAOYSA-N |
Chemical Property Profile of 3-Nitrophenyl dibutylphosphinate
Property Insights of 3-Nitrophenyl dibutylphosphinate
The XLogP value of 3.6 indicates that 3-Nitrophenyl dibutylphosphinate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Nitrophenyl dibutylphosphinate. Following Lipinski's Rule of Five, 3-Nitrophenyl dibutylphosphinate 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
What is the CAS number of 3-Nitrophenyl dibutylphosphinate?
The CAS number of 3-Nitrophenyl dibutylphosphinate is 74038-27-0.
What is the molecular formula of 3-Nitrophenyl dibutylphosphinate?
The molecular formula of 3-Nitrophenyl dibutylphosphinate is C14H22NO4P.
What is the molecular weight of 3-Nitrophenyl dibutylphosphinate?
The molecular weight of 3-Nitrophenyl dibutylphosphinate is 299.12863 g/mol.
Where can I buy 3-Nitrophenyl dibutylphosphinate?
You can request a quote for 3-Nitrophenyl dibutylphosphinate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-Nitrophenyl dibutylphosphinate?
Yes, CoreyChem provides custom synthesis services for 3-Nitrophenyl dibutylphosphinate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.