2-(2-chloro-4-cyanophenoxy)-N-(prop-2-yn-1-yl)acetamide
TL;DR: 2-(2-chloro-4-cyanophenoxy)-N-(prop-2-yn-1-yl)acetamide (CAS 1211010-64-8) is a chemical compound with molecular formula C12H9ClN2O2 and molecular weight 248.03525 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(2-chloro-4-cyanophenoxy)-N-prop-2-ynylacetamide
Also Known As: 2-(2-chloro-4-cyanophenoxy)-N-(prop-2-yn-1-yl)acetamide, 2-(2-chloro-4-cyanophenoxy)-N-prop-2-ynylacetamide
Technical Specifications
| Molecular Formula | C12H9ClN2O2 |
| Molecular Weight | 248.03525 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 62.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 248.03525 Da |
| Heavy Atoms | 17 |
| Complexity | 365.0 |
| SMILES | C#CCNC(=O)COC1=C(C=C(C=C1)C#N)Cl |
| InChIKey | GHVWYVSMRCXHJK-UHFFFAOYSA-N |
Chemical Property Profile of 2-(2-chloro-4-cyanophenoxy)-N-(prop-2-yn-1-yl)acetamide
Property Insights of 2-(2-chloro-4-cyanophenoxy)-N-(prop-2-yn-1-yl)acetamide
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2-chloro-4-cyanophenoxy)-N-(prop-2-yn-1-yl)acetamide. The TPSA of 62.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2-chloro-4-cyanophenoxy)-N-(prop-2-yn-1-yl)acetamide. Following Lipinski's Rule of Five, 2-(2-chloro-4-cyanophenoxy)-N-(prop-2-yn-1-yl)acetamide has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-(2-chloro-4-cyanophenoxy)-N-(prop-2-yn-1-yl)acetamide?
The CAS number of 2-(2-chloro-4-cyanophenoxy)-N-(prop-2-yn-1-yl)acetamide is 1211010-64-8.
What is the molecular formula of 2-(2-chloro-4-cyanophenoxy)-N-(prop-2-yn-1-yl)acetamide?
The molecular formula of 2-(2-chloro-4-cyanophenoxy)-N-(prop-2-yn-1-yl)acetamide is C12H9ClN2O2.
What is the molecular weight of 2-(2-chloro-4-cyanophenoxy)-N-(prop-2-yn-1-yl)acetamide?
The molecular weight of 2-(2-chloro-4-cyanophenoxy)-N-(prop-2-yn-1-yl)acetamide is 248.03525 g/mol.
Where can I buy 2-(2-chloro-4-cyanophenoxy)-N-(prop-2-yn-1-yl)acetamide?
You can request a quote for 2-(2-chloro-4-cyanophenoxy)-N-(prop-2-yn-1-yl)acetamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(2-chloro-4-cyanophenoxy)-N-(prop-2-yn-1-yl)acetamide?
Yes, CoreyChem provides custom synthesis services for 2-(2-chloro-4-cyanophenoxy)-N-(prop-2-yn-1-yl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.