Propanenitrile, 3,3',3''-phosphinylidynetris-
TL;DR: Propanenitrile, 3,3',3''-phosphinylidynetris- (CAS 1439-41-4) is a chemical compound with molecular formula C9H12N3OP and molecular weight 209.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[bis(2-cyanoethyl)phosphoryl]propanenitrile
Also Known As: tris phosphineoxide, Tris(2-cyanoethyl)phosphine oxide, Tris(cyanoethyl)phosphine oxide, 3,3',3''-phosphoryltripropanenitrile, Propanenitrile, 3,3',3''-phosphinylidynetris-
| Molecular Formula | C9H12N3OP |
|---|---|
| Molecular Weight | 209.07 g/mol |
| LogP | -1.6 |
| Topological Polar Surface Area | 88.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 209.0718 |
| Heavy Atoms | 14 |
| Complexity | 304.0 |
Chemical Identifiers
| CAS Number | 1439-41-4 |
|---|---|
| SMILES | C(CP(=O)(CCC#N)CCC#N)C#N |
| InChIKey | ILFYYSUCZQEGOL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Propanenitrile, 3,3',3''-phosphinylidynetris- (CAS 1439-41-4), with molecular formula C9H12N3OP and molecular weight 209.07 g/mol. IUPAC: 3-[bis(2-cyanoethyl)phosphoryl]propanenitrile.
Chemical Property Profile of Propanenitrile, 3,3',3''-phosphinylidynetris-
Property Insights of Propanenitrile, 3,3',3''-phosphinylidynetris-
The XLogP value of -1.6 indicates that Propanenitrile, 3,3',3''-phosphinylidynetris- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 88.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Propanenitrile, 3,3',3''-phosphinylidynetris-. Following Lipinski's Rule of Five, Propanenitrile, 3,3',3''-phosphinylidynetris- 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
Frequently Asked Questions
What is the CAS number of Propanenitrile, 3,3',3''-phosphinylidynetris-?
The CAS number of Propanenitrile, 3,3',3''-phosphinylidynetris- is 1439-41-4.
What is the molecular formula of Propanenitrile, 3,3',3''-phosphinylidynetris-?
The molecular formula of Propanenitrile, 3,3',3''-phosphinylidynetris- is C9H12N3OP.
What is the molecular weight of Propanenitrile, 3,3',3''-phosphinylidynetris-?
The molecular weight of Propanenitrile, 3,3',3''-phosphinylidynetris- is 209.07 g/mol.
Where can I buy Propanenitrile, 3,3',3''-phosphinylidynetris-?
You can request a quote for Propanenitrile, 3,3',3''-phosphinylidynetris- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propanenitrile, 3,3',3''-phosphinylidynetris-?
Yes, KEHONG BIO provides custom synthesis services for Propanenitrile, 3,3',3''-phosphinylidynetris- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.