N-benzyl-2,2,2-trifluoro-N-methylacetamide
TL;DR: N-benzyl-2,2,2-trifluoro-N-methylacetamide (CAS 68464-36-8) is a chemical compound with molecular formula C10H10F3NO and molecular weight 217.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-benzyl-2,2,2-trifluoro-N-methylacetamide
Also Known As: N-Benzyl-2,2,2-trifluoro-N-methylacetamide, starbld0036357, N-Methylbenzylamine, TFA, Acetamide, 2,2,2-trifluoro-N-methyl-N-(phenylmethyl)-, Trifluoroacetamide, N-benzyl-N-methyl-
| Molecular Formula | C10H10F3NO |
|---|---|
| Molecular Weight | 217.07 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 20.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 217.07144 |
| Heavy Atoms | 15 |
| Complexity | 221.0 |
Chemical Identifiers
| CAS Number | 68464-36-8 |
|---|---|
| SMILES | CN(CC1=CC=CC=C1)C(=O)C(F)(F)F |
| InChIKey | VGRXJRLQGWBMQL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-benzyl-2,2,2-trifluoro-N-methylacetamide (CAS 68464-36-8), with molecular formula C10H10F3NO and molecular weight 217.07 g/mol. IUPAC: N-benzyl-2,2,2-trifluoro-N-methylacetamide.
Chemical Property Profile of N-benzyl-2,2,2-trifluoro-N-methylacetamide
Property Insights of N-benzyl-2,2,2-trifluoro-N-methylacetamide
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-benzyl-2,2,2-trifluoro-N-methylacetamide. With a topological polar surface area (TPSA) of 20.3 Ų, N-benzyl-2,2,2-trifluoro-N-methylacetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-benzyl-2,2,2-trifluoro-N-methylacetamide has 0 hydrogen bond donor(s) and 4 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-benzyl-2,2,2-trifluoro-N-methylacetamide?
The CAS number of N-benzyl-2,2,2-trifluoro-N-methylacetamide is 68464-36-8.
What is the molecular formula of N-benzyl-2,2,2-trifluoro-N-methylacetamide?
The molecular formula of N-benzyl-2,2,2-trifluoro-N-methylacetamide is C10H10F3NO.
What is the molecular weight of N-benzyl-2,2,2-trifluoro-N-methylacetamide?
The molecular weight of N-benzyl-2,2,2-trifluoro-N-methylacetamide is 217.07 g/mol.
Where can I buy N-benzyl-2,2,2-trifluoro-N-methylacetamide?
You can request a quote for N-benzyl-2,2,2-trifluoro-N-methylacetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-benzyl-2,2,2-trifluoro-N-methylacetamide?
Yes, KEHONG BIO provides custom synthesis services for N-benzyl-2,2,2-trifluoro-N-methylacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.