N-Methylbis(trifluoroacetyl)imide
TL;DR: N-Methylbis(trifluoroacetyl)imide (CAS 685-27-8) is a chemical compound with molecular formula C5H3F6NO2 and molecular weight 223.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2,2-trifluoro-N-methyl-N-(2,2,2-trifluoroacetyl)acetamide
Also Known As: MBTFA, N-Methyl-bis(trifluoroacetamide), N-Methylbis(trifluoroacetamide), Bistrifluoroacetamide, 2,2,2-Trifluoro-N-methyl-N-(trifluoroacetyl)acetamide
| Molecular Formula | C5H3F6NO2 |
|---|---|
| Molecular Weight | 223.01 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 37.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 0 |
| Exact Mass | 223.00679 |
| Heavy Atoms | 14 |
| Complexity | 228.0 |
Chemical Identifiers
| CAS Number | 685-27-8 |
|---|---|
| SMILES | CN(C(=O)C(F)(F)F)C(=O)C(F)(F)F |
| InChIKey | AWGBWLXGUPTXHF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-Methylbis(trifluoroacetyl)imide (CAS 685-27-8), with molecular formula C5H3F6NO2 and molecular weight 223.01 g/mol. IUPAC: 2,2,2-trifluoro-N-methyl-N-(2,2,2-trifluoroacetyl)acetamide.
Chemical Property Profile of N-Methylbis(trifluoroacetyl)imide
Property Insights of N-Methylbis(trifluoroacetyl)imide
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Methylbis(trifluoroacetyl)imide. With a topological polar surface area (TPSA) of 37.4 Ų, N-Methylbis(trifluoroacetyl)imide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-Methylbis(trifluoroacetyl)imide has 0 hydrogen bond donor(s) and 8 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-Methylbis(trifluoroacetyl)imide?
The CAS number of N-Methylbis(trifluoroacetyl)imide is 685-27-8.
What is the molecular formula of N-Methylbis(trifluoroacetyl)imide?
The molecular formula of N-Methylbis(trifluoroacetyl)imide is C5H3F6NO2.
What is the molecular weight of N-Methylbis(trifluoroacetyl)imide?
The molecular weight of N-Methylbis(trifluoroacetyl)imide is 223.01 g/mol.
Where can I buy N-Methylbis(trifluoroacetyl)imide?
You can request a quote for N-Methylbis(trifluoroacetyl)imide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Methylbis(trifluoroacetyl)imide?
Yes, KEHONG BIO provides custom synthesis services for N-Methylbis(trifluoroacetyl)imide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.