Butyl bis(1-cyanobutyl) phosphate
TL;DR: Butyl bis(1-cyanobutyl) phosphate (CAS 73972-72-2) is a chemical compound with molecular formula C14H25N2O4P and molecular weight 316.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
butyl bis(1-cyanobutyl) phosphate
Also Known As: Bis(1-cyanobutyl) butyl phosphate, butyl bis(1-cyanobutyl) phosphate, Bis(1-cyanobutyl)butyl=phosphate, Phosphoric acid, bis(1-cyanobutyl) butyl ester, Phosphoric acid, butyl bis(1-cyanobutyl) ester
| Molecular Formula | C14H25N2O4P |
|---|---|
| Molecular Weight | 316.16 g/mol |
| LogP | 4.32896 |
| Topological Polar Surface Area | 92.34 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 12 |
| Exact Mass | 316.15518 |
| Heavy Atoms | 21 |
| Complexity | 372.75864 |
Chemical Identifiers
| CAS Number | 73972-72-2 |
|---|---|
| SMILES | CCCCOP(=O)(OC(CCC)C#N)OC(CCC)C#N |
Product Overview
Butyl bis(1-cyanobutyl) phosphate (CAS 73972-72-2), with molecular formula C14H25N2O4P and molecular weight 316.16 g/mol. IUPAC: butyl bis(1-cyanobutyl) phosphate.
Chemical Property Profile of Butyl bis(1-cyanobutyl) phosphate
Property Insights of Butyl bis(1-cyanobutyl) phosphate
The XLogP value of 4.32896 indicates that Butyl bis(1-cyanobutyl) phosphate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.34 Ų falls within the moderate polarity range, balancing permeability and solubility for Butyl bis(1-cyanobutyl) phosphate. Following Lipinski's Rule of Five, Butyl bis(1-cyanobutyl) phosphate has 0 hydrogen bond donor(s) and 6 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 Butyl bis(1-cyanobutyl) phosphate?
The CAS number of Butyl bis(1-cyanobutyl) phosphate is 73972-72-2.
What is the molecular formula of Butyl bis(1-cyanobutyl) phosphate?
The molecular formula of Butyl bis(1-cyanobutyl) phosphate is C14H25N2O4P.
What is the molecular weight of Butyl bis(1-cyanobutyl) phosphate?
The molecular weight of Butyl bis(1-cyanobutyl) phosphate is 316.16 g/mol.
Where can I buy Butyl bis(1-cyanobutyl) phosphate?
You can request a quote for Butyl bis(1-cyanobutyl) phosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butyl bis(1-cyanobutyl) phosphate?
Yes, KEHONG BIO provides custom synthesis services for Butyl bis(1-cyanobutyl) phosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.