4-Chloro-n-(2-cyanoethyl)benzamide
TL;DR: 4-Chloro-n-(2-cyanoethyl)benzamide (CAS 22192-82-1) 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.
4-chloro-N-(2-cyanoethyl)benzamide
Also Known As: 4-Chloro-n-(2-cyanoethyl)benzamide
| Molecular Formula | C10H9ClN2O |
|---|---|
| Molecular Weight | 208.04 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 52.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 208.04034 |
| Heavy Atoms | 14 |
| Complexity | 238.0 |
Chemical Identifiers
| CAS Number | 22192-82-1 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=O)NCCC#N)Cl |
| InChIKey | CXBXWIVEMGBDTH-UHFFFAOYSA-N |
Product Overview
4-Chloro-n-(2-cyanoethyl)benzamide (CAS 22192-82-1), with molecular formula C10H9ClN2O and molecular weight 208.04 g/mol. IUPAC: 4-chloro-N-(2-cyanoethyl)benzamide.
Chemical Property Profile of 4-Chloro-n-(2-cyanoethyl)benzamide
Property Insights of 4-Chloro-n-(2-cyanoethyl)benzamide
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Chloro-n-(2-cyanoethyl)benzamide. With a topological polar surface area (TPSA) of 52.9 Ų, 4-Chloro-n-(2-cyanoethyl)benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Chloro-n-(2-cyanoethyl)benzamide 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 4-Chloro-n-(2-cyanoethyl)benzamide?
The CAS number of 4-Chloro-n-(2-cyanoethyl)benzamide is 22192-82-1.
What is the molecular formula of 4-Chloro-n-(2-cyanoethyl)benzamide?
The molecular formula of 4-Chloro-n-(2-cyanoethyl)benzamide is C10H9ClN2O.
What is the molecular weight of 4-Chloro-n-(2-cyanoethyl)benzamide?
The molecular weight of 4-Chloro-n-(2-cyanoethyl)benzamide is 208.04 g/mol.
Where can I buy 4-Chloro-n-(2-cyanoethyl)benzamide?
You can request a quote for 4-Chloro-n-(2-cyanoethyl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Chloro-n-(2-cyanoethyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-Chloro-n-(2-cyanoethyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.