N-Butyl-2,2-dichloroacetamide
TL;DR: N-Butyl-2,2-dichloroacetamide (CAS 4265-07-0) is a chemical compound with molecular formula C6H11Cl2NO and molecular weight 183.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-butyl-2,2-dichloroacetamide
Also Known As: N-BUTYL-2,2-DICHLOROACETAMIDE, trichloro-acetic acid butylamide, N-Butyldi(chloro)ethanimidic acid, N-Butyl-2,2-dichloroethanimidic acid
| Molecular Formula | C6H11Cl2NO |
|---|---|
| Molecular Weight | 183.02 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 183.02177 |
| Heavy Atoms | 10 |
| Complexity | 106.0 |
Chemical Identifiers
| CAS Number | 4265-07-0 |
|---|---|
| SMILES | CCCCNC(=O)C(Cl)Cl |
| InChIKey | JBYXKEJXXFUJKU-UHFFFAOYSA-N |
Product Overview
N-Butyl-2,2-dichloroacetamide (CAS 4265-07-0), with molecular formula C6H11Cl2NO and molecular weight 183.02 g/mol. IUPAC: N-butyl-2,2-dichloroacetamide.
Chemical Property Profile of N-Butyl-2,2-dichloroacetamide
Property Insights of N-Butyl-2,2-dichloroacetamide
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Butyl-2,2-dichloroacetamide. With a topological polar surface area (TPSA) of 29.1 Ų, N-Butyl-2,2-dichloroacetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-Butyl-2,2-dichloroacetamide 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 N-Butyl-2,2-dichloroacetamide?
The CAS number of N-Butyl-2,2-dichloroacetamide is 4265-07-0.
What is the molecular formula of N-Butyl-2,2-dichloroacetamide?
The molecular formula of N-Butyl-2,2-dichloroacetamide is C6H11Cl2NO.
What is the molecular weight of N-Butyl-2,2-dichloroacetamide?
The molecular weight of N-Butyl-2,2-dichloroacetamide is 183.02 g/mol.
Where can I buy N-Butyl-2,2-dichloroacetamide?
You can request a quote for N-Butyl-2,2-dichloroacetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Butyl-2,2-dichloroacetamide?
Yes, KEHONG BIO provides custom synthesis services for N-Butyl-2,2-dichloroacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.