2,2,2-trifluoro-N-(1-phenylethyl)acetamide
TL;DR: 2,2,2-trifluoro-N-(1-phenylethyl)acetamide (CAS 39995-50-1) 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.
2,2,2-trifluoro-N-(1-phenylethyl)acetamide
Also Known As: 2,2,2-trifluoro-N-(1-phenylethyl)acetamide, (R)-1-Phenylethyltrifluoroacetamide, N-(1-Phenylethyl)trifluoroacetamide, N-(alpha-Methylbenzyl)trifluoroacetamide, Acetamide, 2,2,2-trifluoro-N-(1-phenylethyl)-
| Molecular Formula | C10H10F3NO |
|---|---|
| Molecular Weight | 217.07 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 217.07144 |
| Heavy Atoms | 15 |
| Complexity | 221.0 |
Chemical Identifiers
| CAS Number | 39995-50-1 |
|---|---|
| SMILES | CC(C1=CC=CC=C1)NC(=O)C(F)(F)F |
| InChIKey | ZJFCMJDNHPXGBY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,2,2-trifluoro-N-(1-phenylethyl)acetamide (CAS 39995-50-1), with molecular formula C10H10F3NO and molecular weight 217.07 g/mol. IUPAC: 2,2,2-trifluoro-N-(1-phenylethyl)acetamide.
Chemical Property Profile of 2,2,2-trifluoro-N-(1-phenylethyl)acetamide
Property Insights of 2,2,2-trifluoro-N-(1-phenylethyl)acetamide
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,2,2-trifluoro-N-(1-phenylethyl)acetamide. With a topological polar surface area (TPSA) of 29.1 Ų, 2,2,2-trifluoro-N-(1-phenylethyl)acetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2,2-trifluoro-N-(1-phenylethyl)acetamide has 1 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 2,2,2-trifluoro-N-(1-phenylethyl)acetamide?
The CAS number of 2,2,2-trifluoro-N-(1-phenylethyl)acetamide is 39995-50-1.
What is the molecular formula of 2,2,2-trifluoro-N-(1-phenylethyl)acetamide?
The molecular formula of 2,2,2-trifluoro-N-(1-phenylethyl)acetamide is C10H10F3NO.
What is the molecular weight of 2,2,2-trifluoro-N-(1-phenylethyl)acetamide?
The molecular weight of 2,2,2-trifluoro-N-(1-phenylethyl)acetamide is 217.07 g/mol.
Where can I buy 2,2,2-trifluoro-N-(1-phenylethyl)acetamide?
You can request a quote for 2,2,2-trifluoro-N-(1-phenylethyl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2,2-trifluoro-N-(1-phenylethyl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2,2,2-trifluoro-N-(1-phenylethyl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.