![2-chloro-N-[4-(cyanomethyl)phenyl]acetamide structure](/static/products/907/90772-87-5.png)
2-chloro-N-[4-(cyanomethyl)phenyl]acetamide
TL;DR: 2-chloro-N-[4-(cyanomethyl)phenyl]acetamide (CAS 90772-87-5) is a chemical compound with molecular formula C10H9ClN2O and molecular weight 208.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-N-[4-(cyanomethyl)phenyl]acetamide
Also Known As: 2-chloro-N-[4-(cyanomethyl)phenyl]acetamide, p-Chloracetamido-phenylacetonitril, 4-(2-Chloroacetylamino)benzylcyanide, 2-Chloro-N-(4-(cyanomethyl)phenyl)acetamide, 2-CHLORO-N-[4- PHENYL]ACETAMIDE
| Molecular Formula | C10H9ClN2O |
|---|---|
| Molecular Weight | 208.04 g/mol |
| LogP | 1.92998 |
| Topological Polar Surface Area | 52.89 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 208.04034 |
| Heavy Atoms | 14 |
| Complexity | 353.3799 |
Chemical Identifiers
| CAS Number | 90772-87-5 |
|---|---|
| SMILES | C1=CC(=CC=C1CC#N)NC(=O)CCl |
Product Overview
2-chloro-N-[4-(cyanomethyl)phenyl]acetamide (CAS 90772-87-5), with molecular formula C10H9ClN2O and molecular weight 208.04 g/mol. IUPAC: 2-chloro-N-[4-(cyanomethyl)phenyl]acetamide.
Chemical Property Profile of 2-chloro-N-[4-(cyanomethyl)phenyl]acetamide
Property Insights of 2-chloro-N-[4-(cyanomethyl)phenyl]acetamide
The XLogP value of 1.92998 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-chloro-N-[4-(cyanomethyl)phenyl]acetamide. With a topological polar surface area (TPSA) of 52.89 Ų, 2-chloro-N-[4-(cyanomethyl)phenyl]acetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-chloro-N-[4-(cyanomethyl)phenyl]acetamide has 1 hydrogen bond donor(s) and 2 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-chloro-N-[4-(cyanomethyl)phenyl]acetamide?
The CAS number of 2-chloro-N-[4-(cyanomethyl)phenyl]acetamide is 90772-87-5.
What is the molecular formula of 2-chloro-N-[4-(cyanomethyl)phenyl]acetamide?
The molecular formula of 2-chloro-N-[4-(cyanomethyl)phenyl]acetamide is C10H9ClN2O.
What is the molecular weight of 2-chloro-N-[4-(cyanomethyl)phenyl]acetamide?
The molecular weight of 2-chloro-N-[4-(cyanomethyl)phenyl]acetamide is 208.04 g/mol.
Where can I buy 2-chloro-N-[4-(cyanomethyl)phenyl]acetamide?
You can request a quote for 2-chloro-N-[4-(cyanomethyl)phenyl]acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-chloro-N-[4-(cyanomethyl)phenyl]acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-chloro-N-[4-(cyanomethyl)phenyl]acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.