![4-[2-(Dimethylamino)ethoxy]benzonitrile structure](/static/products/2419/24197-95-3.webp)
4-[2-(Dimethylamino)ethoxy]benzonitrile
TL;DR: 4-[2-(Dimethylamino)ethoxy]benzonitrile (CAS 24197-95-3) is a chemical compound with molecular formula C11H14N2O and molecular weight 190.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[2-(dimethylamino)ethoxy]benzonitrile
Also Known As: 4-[2-(dimethylamino)ethoxy]benzonitrile, Itopride Impurity 8, Benzonitrile, 4-[2-(dimethylamino)ethoxy]-, 4-(2-(Dimethylamino)ethoxy)benzonitrile, 4-(2-Dimethylaminoethoxy)benzonitrile
| Molecular Formula | C11H14N2O |
|---|---|
| Molecular Weight | 190.11 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 36.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 190.11061 |
| Heavy Atoms | 14 |
| Complexity | 199.0 |
Chemical Identifiers
| CAS Number | 24197-95-3 |
|---|---|
| SMILES | CN(C)CCOC1=CC=C(C=C1)C#N |
| InChIKey | DTYDLVIYHGGCOG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-[2-(Dimethylamino)ethoxy]benzonitrile (CAS 24197-95-3), with molecular formula C11H14N2O and molecular weight 190.11 g/mol. IUPAC: 4-[2-(dimethylamino)ethoxy]benzonitrile.
Chemical Property Profile of 4-[2-(Dimethylamino)ethoxy]benzonitrile
Property Insights of 4-[2-(Dimethylamino)ethoxy]benzonitrile
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[2-(Dimethylamino)ethoxy]benzonitrile. With a topological polar surface area (TPSA) of 36.3 Ų, 4-[2-(Dimethylamino)ethoxy]benzonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[2-(Dimethylamino)ethoxy]benzonitrile has 0 hydrogen bond donor(s) and 3 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 4-[2-(Dimethylamino)ethoxy]benzonitrile?
The CAS number of 4-[2-(Dimethylamino)ethoxy]benzonitrile is 24197-95-3.
What is the molecular formula of 4-[2-(Dimethylamino)ethoxy]benzonitrile?
The molecular formula of 4-[2-(Dimethylamino)ethoxy]benzonitrile is C11H14N2O.
What is the molecular weight of 4-[2-(Dimethylamino)ethoxy]benzonitrile?
The molecular weight of 4-[2-(Dimethylamino)ethoxy]benzonitrile is 190.11 g/mol.
Where can I buy 4-[2-(Dimethylamino)ethoxy]benzonitrile?
You can request a quote for 4-[2-(Dimethylamino)ethoxy]benzonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[2-(Dimethylamino)ethoxy]benzonitrile?
Yes, KEHONG BIO provides custom synthesis services for 4-[2-(Dimethylamino)ethoxy]benzonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.