Butylbis(3-nitrophenyl)phosphine oxide
TL;DR: Butylbis(3-nitrophenyl)phosphine oxide (CAS 115663-88-2) is a chemical compound with molecular formula C16H17N2O5P and molecular weight 348.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[butyl-(3-nitrophenyl)phosphoryl]-3-nitrobenzene
Also Known As: Butylbis(3-nitrophenyl)phosphine oxide, BIS-(3-NITROPHENYL)-BUTYLPHOSPHINE OXIDE, 1-[butyl-(3-nitrophenyl)phosphoryl]-3-nitrobenzene, 1-[butyl-(3-nitrophenyl)phosphoryl]-3-nitro-benzene
| Molecular Formula | C16H17N2O5P |
|---|---|
| Molecular Weight | 348.09 g/mol |
| LogP | 3.617 |
| Topological Polar Surface Area | 103.35 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 348.0875 |
| Heavy Atoms | 24 |
| Complexity | 760.12 |
Chemical Identifiers
| CAS Number | 115663-88-2 |
|---|---|
| SMILES | CCCCP(=O)(C1=CC=CC(=C1)[N+](=O)[O-])C2=CC=CC(=C2)[N+](=O)[O-] |
Product Overview
Butylbis(3-nitrophenyl)phosphine oxide (CAS 115663-88-2), with molecular formula C16H17N2O5P and molecular weight 348.09 g/mol. IUPAC: 1-[butyl-(3-nitrophenyl)phosphoryl]-3-nitrobenzene.
Chemical Property Profile of Butylbis(3-nitrophenyl)phosphine oxide
Property Insights of Butylbis(3-nitrophenyl)phosphine oxide
The XLogP value of 3.617 indicates that Butylbis(3-nitrophenyl)phosphine oxide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 103.35 Ų falls within the moderate polarity range, balancing permeability and solubility for Butylbis(3-nitrophenyl)phosphine oxide. Following Lipinski's Rule of Five, Butylbis(3-nitrophenyl)phosphine oxide 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 Butylbis(3-nitrophenyl)phosphine oxide?
The CAS number of Butylbis(3-nitrophenyl)phosphine oxide is 115663-88-2.
What is the molecular formula of Butylbis(3-nitrophenyl)phosphine oxide?
The molecular formula of Butylbis(3-nitrophenyl)phosphine oxide is C16H17N2O5P.
What is the molecular weight of Butylbis(3-nitrophenyl)phosphine oxide?
The molecular weight of Butylbis(3-nitrophenyl)phosphine oxide is 348.09 g/mol.
Where can I buy Butylbis(3-nitrophenyl)phosphine oxide?
You can request a quote for Butylbis(3-nitrophenyl)phosphine oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butylbis(3-nitrophenyl)phosphine oxide?
Yes, KEHONG BIO provides custom synthesis services for Butylbis(3-nitrophenyl)phosphine oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.