N,N-dimethyltrichloroacetamide
TL;DR: N,N-dimethyltrichloroacetamide (CAS 7291-33-0) is a chemical compound with molecular formula C4H6Cl3NO and molecular weight 188.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2,2-trichloro-N,N-dimethylacetamide
Also Known As: 2,2,2-Trichloro-N,N-dimethylacetamide, 4-Methoxystilbene, NN-Dimethyltrichloroacetamide, n,n-dimethyltrichloroacetamide, 2,2,2-Trichloro-NN-dimethylacetamide
| Molecular Formula | C4H6Cl3NO |
|---|---|
| Molecular Weight | 188.95 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 20.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 188.95149 |
| Heavy Atoms | 9 |
| Complexity | 117.0 |
Chemical Identifiers
| CAS Number | 7291-33-0 |
|---|---|
| SMILES | CN(C)C(=O)C(Cl)(Cl)Cl |
| InChIKey | WGBMKQSRUSKSOM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N,N-dimethyltrichloroacetamide (CAS 7291-33-0), with molecular formula C4H6Cl3NO and molecular weight 188.95 g/mol. IUPAC: 2,2,2-trichloro-N,N-dimethylacetamide.
Chemical Property Profile of N,N-dimethyltrichloroacetamide
Property Insights of N,N-dimethyltrichloroacetamide
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,N-dimethyltrichloroacetamide. With a topological polar surface area (TPSA) of 20.3 Ų, N,N-dimethyltrichloroacetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N-dimethyltrichloroacetamide 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,N-dimethyltrichloroacetamide?
The CAS number of N,N-dimethyltrichloroacetamide is 7291-33-0.
What is the molecular formula of N,N-dimethyltrichloroacetamide?
The molecular formula of N,N-dimethyltrichloroacetamide is C4H6Cl3NO.
What is the molecular weight of N,N-dimethyltrichloroacetamide?
The molecular weight of N,N-dimethyltrichloroacetamide is 188.95 g/mol.
Where can I buy N,N-dimethyltrichloroacetamide?
You can request a quote for N,N-dimethyltrichloroacetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N-dimethyltrichloroacetamide?
Yes, KEHONG BIO provides custom synthesis services for N,N-dimethyltrichloroacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.