N-Chloroacetanilide
TL;DR: N-Chloroacetanilide (CAS 579-11-3) is a chemical compound with molecular formula C8H8ClNO and molecular weight 169.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-chloro-N-phenylacetamide
Also Known As: N-Chloroacetanilide, N-chloro-N-phenylacetamide, N-Chloroacetoanilide, ACETANILIDE, N-CHLORO-, N-chloro-N-phenyl-acetamide
| Molecular Formula | C8H8ClNO |
|---|---|
| Molecular Weight | 169.03 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 20.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 169.02943 |
| Heavy Atoms | 11 |
| Complexity | 143.0 |
Chemical Identifiers
| CAS Number | 579-11-3 |
|---|---|
| SMILES | CC(=O)N(C1=CC=CC=C1)Cl |
| InChIKey | QNVKMXGRFVLMBM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-Chloroacetanilide (CAS 579-11-3), with molecular formula C8H8ClNO and molecular weight 169.03 g/mol. IUPAC: N-chloro-N-phenylacetamide.
Chemical Property Profile of N-Chloroacetanilide
Property Insights of N-Chloroacetanilide
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Chloroacetanilide. With a topological polar surface area (TPSA) of 20.3 Ų, N-Chloroacetanilide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-Chloroacetanilide has 0 hydrogen bond donor(s) and 1 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 N-Chloroacetanilide?
The CAS number of N-Chloroacetanilide is 579-11-3.
What is the molecular formula of N-Chloroacetanilide?
The molecular formula of N-Chloroacetanilide is C8H8ClNO.
What is the molecular weight of N-Chloroacetanilide?
The molecular weight of N-Chloroacetanilide is 169.03 g/mol.
Where can I buy N-Chloroacetanilide?
You can request a quote for N-Chloroacetanilide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Chloroacetanilide?
Yes, KEHONG BIO provides custom synthesis services for N-Chloroacetanilide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.