2-chloro-N-(3-chloro-4-fluorophenyl)acetamide
TL;DR: 2-chloro-N-(3-chloro-4-fluorophenyl)acetamide (CAS 98864-90-5) is a chemical compound with molecular formula C8H6Cl2FNO and molecular weight 220.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-N-(3-chloro-4-fluorophenyl)acetamide
Also Known As: 2-chloro-N-(3-chloro-4-fluorophenyl)acetamide, 3-chloro-n-(chloroacetyl)-4-fluoroaniline, 5-Fluoro-6-methylisatin, 2,3'-Dichloro-4'-fluoroacetanilide, 2,3'-dichloro-4-fluoroacetanilide
| Molecular Formula | C8H6Cl2FNO |
|---|---|
| Molecular Weight | 220.98 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 220.98105 |
| Heavy Atoms | 13 |
| Complexity | 191.0 |
Chemical Identifiers
| CAS Number | 98864-90-5 |
|---|---|
| SMILES | C1=CC(=C(C=C1NC(=O)CCl)Cl)F |
| InChIKey | DJPAQYXQRCWKEH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-chloro-N-(3-chloro-4-fluorophenyl)acetamide (CAS 98864-90-5), with molecular formula C8H6Cl2FNO and molecular weight 220.98 g/mol. IUPAC: 2-chloro-N-(3-chloro-4-fluorophenyl)acetamide.
Chemical Property Profile of 2-chloro-N-(3-chloro-4-fluorophenyl)acetamide
Property Insights of 2-chloro-N-(3-chloro-4-fluorophenyl)acetamide
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-chloro-N-(3-chloro-4-fluorophenyl)acetamide. With a topological polar surface area (TPSA) of 29.1 Ų, 2-chloro-N-(3-chloro-4-fluorophenyl)acetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-chloro-N-(3-chloro-4-fluorophenyl)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-(3-chloro-4-fluorophenyl)acetamide?
The CAS number of 2-chloro-N-(3-chloro-4-fluorophenyl)acetamide is 98864-90-5.
What is the molecular formula of 2-chloro-N-(3-chloro-4-fluorophenyl)acetamide?
The molecular formula of 2-chloro-N-(3-chloro-4-fluorophenyl)acetamide is C8H6Cl2FNO.
What is the molecular weight of 2-chloro-N-(3-chloro-4-fluorophenyl)acetamide?
The molecular weight of 2-chloro-N-(3-chloro-4-fluorophenyl)acetamide is 220.98 g/mol.
Where can I buy 2-chloro-N-(3-chloro-4-fluorophenyl)acetamide?
You can request a quote for 2-chloro-N-(3-chloro-4-fluorophenyl)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-(3-chloro-4-fluorophenyl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-chloro-N-(3-chloro-4-fluorophenyl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.