2-(4-cyano-2-ethoxyphenoxy)-N,N-dimethylacetamide
TL;DR: 2-(4-cyano-2-ethoxyphenoxy)-N,N-dimethylacetamide (CAS 1031531-72-2) is a chemical compound with molecular formula C13H16N2O3 and molecular weight 248.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-cyano-2-ethoxyphenoxy)-N,N-dimethylacetamide
Also Known As: 2-(4-cyano-2-ethoxyphenoxy)-N,N-dimethylacetamide
| Molecular Formula | C13H16N2O3 |
|---|---|
| Molecular Weight | 248.12 g/mol |
| LogP | 1.42398 |
| Topological Polar Surface Area | 62.56 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 248.11609 |
| Heavy Atoms | 18 |
| Complexity | 463.79443 |
Chemical Identifiers
| CAS Number | 1031531-72-2 |
|---|---|
| SMILES | CCOC1=C(C=CC(=C1)C#N)OCC(=O)N(C)C |
Product Overview
2-(4-cyano-2-ethoxyphenoxy)-N,N-dimethylacetamide (CAS 1031531-72-2), with molecular formula C13H16N2O3 and molecular weight 248.12 g/mol. IUPAC: 2-(4-cyano-2-ethoxyphenoxy)-N,N-dimethylacetamide.
Chemical Property Profile of 2-(4-cyano-2-ethoxyphenoxy)-N,N-dimethylacetamide
Property Insights of 2-(4-cyano-2-ethoxyphenoxy)-N,N-dimethylacetamide
The XLogP value of 1.42398 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-cyano-2-ethoxyphenoxy)-N,N-dimethylacetamide. The TPSA of 62.56 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-cyano-2-ethoxyphenoxy)-N,N-dimethylacetamide. Following Lipinski's Rule of Five, 2-(4-cyano-2-ethoxyphenoxy)-N,N-dimethylacetamide 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 2-(4-cyano-2-ethoxyphenoxy)-N,N-dimethylacetamide?
The CAS number of 2-(4-cyano-2-ethoxyphenoxy)-N,N-dimethylacetamide is 1031531-72-2.
What is the molecular formula of 2-(4-cyano-2-ethoxyphenoxy)-N,N-dimethylacetamide?
The molecular formula of 2-(4-cyano-2-ethoxyphenoxy)-N,N-dimethylacetamide is C13H16N2O3.
What is the molecular weight of 2-(4-cyano-2-ethoxyphenoxy)-N,N-dimethylacetamide?
The molecular weight of 2-(4-cyano-2-ethoxyphenoxy)-N,N-dimethylacetamide is 248.12 g/mol.
Where can I buy 2-(4-cyano-2-ethoxyphenoxy)-N,N-dimethylacetamide?
You can request a quote for 2-(4-cyano-2-ethoxyphenoxy)-N,N-dimethylacetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-cyano-2-ethoxyphenoxy)-N,N-dimethylacetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-cyano-2-ethoxyphenoxy)-N,N-dimethylacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.