Tri-n-butylphosphite-p-iron carbonyl dinitrosyl
TL;DR: Tri-n-butylphosphite-p-iron carbonyl dinitrosyl (CAS 21494-33-7) is a chemical compound with molecular formula C13H28FeN2O6P-3 and molecular weight 395.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methanone;nitroxyl anion;(tributoxy-λ5-phosphanylidene)iron
Also Known As: Tri-n-butylphosphite-p-iron carbonyl dinitrosyl
| Molecular Formula | C13H28FeN2O6P-3 |
|---|---|
| Molecular Weight | 395.10 g/mol |
| LogP | 5.0312 |
| Topological Polar Surface Area | 80.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 12 |
| Exact Mass | 395.10342 |
| Heavy Atoms | 23 |
| Complexity | 229.0 |
Chemical Identifiers
| CAS Number | 21494-33-7 |
|---|---|
| SMILES | CCCCOP(=[Fe])(OCCCC)OCCCC.[CH-]=O.[N-]=O.[N-]=O |
| InChIKey | UDVRBSWJURXWPQ-UHFFFAOYSA-N |
Product Overview
Tri-n-butylphosphite-p-iron carbonyl dinitrosyl (CAS 21494-33-7), with molecular formula C13H28FeN2O6P-3 and molecular weight 395.10 g/mol. IUPAC: methanone;nitroxyl anion;(tributoxy-λ5-phosphanylidene)iron.
Chemical Property Profile of Tri-n-butylphosphite-p-iron carbonyl dinitrosyl
Property Insights of Tri-n-butylphosphite-p-iron carbonyl dinitrosyl
The XLogP value of 5.0312 indicates that Tri-n-butylphosphite-p-iron carbonyl dinitrosyl is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Tri-n-butylphosphite-p-iron carbonyl dinitrosyl. Following Lipinski's Rule of Five, Tri-n-butylphosphite-p-iron carbonyl dinitrosyl has 0 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Tri-n-butylphosphite-p-iron carbonyl dinitrosyl?
The CAS number of Tri-n-butylphosphite-p-iron carbonyl dinitrosyl is 21494-33-7.
What is the molecular formula of Tri-n-butylphosphite-p-iron carbonyl dinitrosyl?
The molecular formula of Tri-n-butylphosphite-p-iron carbonyl dinitrosyl is C13H28FeN2O6P-3.
What is the molecular weight of Tri-n-butylphosphite-p-iron carbonyl dinitrosyl?
The molecular weight of Tri-n-butylphosphite-p-iron carbonyl dinitrosyl is 395.10 g/mol.
Where can I buy Tri-n-butylphosphite-p-iron carbonyl dinitrosyl?
You can request a quote for Tri-n-butylphosphite-p-iron carbonyl dinitrosyl directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tri-n-butylphosphite-p-iron carbonyl dinitrosyl?
Yes, KEHONG BIO provides custom synthesis services for Tri-n-butylphosphite-p-iron carbonyl dinitrosyl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.