2-chloro-N-methylacetamide
TL;DR: 2-chloro-N-methylacetamide (CAS 96-30-0) is a chemical compound with molecular formula C3H6ClNO and molecular weight 107.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-N-methylacetamide
Also Known As: 2-Chloro-N-methylacetamide, N-Methyl-2-chloroacetamide, N-Methylchloroacetamide, Acetamide, 2-chloro-N-methyl-, null
| Molecular Formula | C3H6ClNO |
|---|---|
| Molecular Weight | 107.01 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 107.013794 |
| Heavy Atoms | 6 |
| Complexity | 54.0 |
Chemical Identifiers
| CAS Number | 96-30-0 |
|---|---|
| SMILES | CNC(=O)CCl |
| InChIKey | HOZLOOPIXHWKCI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 17 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-chloro-N-methylacetamide (CAS 96-30-0), with molecular formula C3H6ClNO and molecular weight 107.01 g/mol. IUPAC: 2-chloro-N-methylacetamide.
Chemical Property Profile of 2-chloro-N-methylacetamide
Property Insights of 2-chloro-N-methylacetamide
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-chloro-N-methylacetamide. With a topological polar surface area (TPSA) of 29.1 Ų, 2-chloro-N-methylacetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-chloro-N-methylacetamide has 1 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 2-chloro-N-methylacetamide?
The CAS number of 2-chloro-N-methylacetamide is 96-30-0.
What is the molecular formula of 2-chloro-N-methylacetamide?
The molecular formula of 2-chloro-N-methylacetamide is C3H6ClNO.
What is the molecular weight of 2-chloro-N-methylacetamide?
The molecular weight of 2-chloro-N-methylacetamide is 107.01 g/mol.
Where can I buy 2-chloro-N-methylacetamide?
You can request a quote for 2-chloro-N-methylacetamide 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-methylacetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-chloro-N-methylacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.