![3,3'-[(3-Phenoxypropane-1,2-diyl)bis(oxy)]dipropanenitrile structure](/static/products/963/96382-72-8.png)
3,3'-[(3-Phenoxypropane-1,2-diyl)bis(oxy)]dipropanenitrile
TL;DR: 3,3'-[(3-Phenoxypropane-1,2-diyl)bis(oxy)]dipropanenitrile (CAS 96382-72-8) is a chemical compound with molecular formula C15H18N2O3 and molecular weight 274.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[2-(2-cyanoethoxy)-3-phenoxypropoxy]propanenitrile
Also Known As: 3-[2-(2-cyanoethoxy)-3-phenoxypropoxy]propanenitrile, 3,3'-[(3-phenoxypropane-1,2-diyl)bis(oxy)]dipropanenitrile, Propanenitrile,3,3'-[[1-(phenoxymethyl)-1,2-ethanediyl]bis(oxy)]bis- (9CI)
| Molecular Formula | C15H18N2O3 |
|---|---|
| Molecular Weight | 274.13 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 75.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 274.13174 |
| Heavy Atoms | 20 |
| Complexity | 336.0 |
Chemical Identifiers
| CAS Number | 96382-72-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)OCC(COCCC#N)OCCC#N |
| InChIKey | GRFIAICZPZTDMN-UHFFFAOYSA-N |
Product Overview
3,3'-[(3-Phenoxypropane-1,2-diyl)bis(oxy)]dipropanenitrile (CAS 96382-72-8), with molecular formula C15H18N2O3 and molecular weight 274.13 g/mol. IUPAC: 3-[2-(2-cyanoethoxy)-3-phenoxypropoxy]propanenitrile.
Chemical Property Profile of 3,3'-[(3-Phenoxypropane-1,2-diyl)bis(oxy)]dipropanenitrile
Property Insights of 3,3'-[(3-Phenoxypropane-1,2-diyl)bis(oxy)]dipropanenitrile
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,3'-[(3-Phenoxypropane-1,2-diyl)bis(oxy)]dipropanenitrile. The TPSA of 75.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,3'-[(3-Phenoxypropane-1,2-diyl)bis(oxy)]dipropanenitrile. Following Lipinski's Rule of Five, 3,3'-[(3-Phenoxypropane-1,2-diyl)bis(oxy)]dipropanenitrile 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 3,3'-[(3-Phenoxypropane-1,2-diyl)bis(oxy)]dipropanenitrile?
The CAS number of 3,3'-[(3-Phenoxypropane-1,2-diyl)bis(oxy)]dipropanenitrile is 96382-72-8.
What is the molecular formula of 3,3'-[(3-Phenoxypropane-1,2-diyl)bis(oxy)]dipropanenitrile?
The molecular formula of 3,3'-[(3-Phenoxypropane-1,2-diyl)bis(oxy)]dipropanenitrile is C15H18N2O3.
What is the molecular weight of 3,3'-[(3-Phenoxypropane-1,2-diyl)bis(oxy)]dipropanenitrile?
The molecular weight of 3,3'-[(3-Phenoxypropane-1,2-diyl)bis(oxy)]dipropanenitrile is 274.13 g/mol.
Where can I buy 3,3'-[(3-Phenoxypropane-1,2-diyl)bis(oxy)]dipropanenitrile?
You can request a quote for 3,3'-[(3-Phenoxypropane-1,2-diyl)bis(oxy)]dipropanenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3'-[(3-Phenoxypropane-1,2-diyl)bis(oxy)]dipropanenitrile?
Yes, KEHONG BIO provides custom synthesis services for 3,3'-[(3-Phenoxypropane-1,2-diyl)bis(oxy)]dipropanenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.