N-(4-丁基苯基)-2,2,2-三氟乙酰胺
TL;DR: N-(4-丁基苯基)-2,2,2-三氟乙酰胺 (CAS 448250-66-6) is a chemical compound with molecular formula C12H14F3NO and molecular weight 245.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-丁基苯基)-2,2,2-三氟乙酰胺
N-(4-butylphenyl)-2,2,2-trifluoroacetamide
Also Known As: 4-Butylaniline, TFA, NCIOpen2_006401, N-(4-butylphenyl)-2,2,2-trifluoroacetamide, Acetamide, N-(4-butylphenyl)-2,2,2-trifluoro-
| Molecular Formula | C12H14F3NO |
|---|---|
| Molecular Weight | 245.10 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 245.10275 |
| Heavy Atoms | 17 |
| Complexity | 245.0 |
Chemical Identifiers
| CAS Number | 448250-66-6 |
|---|---|
| SMILES | CCCCC1=CC=C(C=C1)NC(=O)C(F)(F)F |
| InChIKey | LBWHWIKUWMDJLJ-UHFFFAOYSA-N |
Product Overview
N-(4-丁基苯基)-2,2,2-三氟乙酰胺 (CAS 448250-66-6), with molecular formula C12H14F3NO and molecular weight 245.10 g/mol. IUPAC: N-(4-butylphenyl)-2,2,2-trifluoroacetamide.
Chemical Property Profile of N-(4-丁基苯基)-2,2,2-三氟乙酰胺
Property Insights of N-(4-丁基苯基)-2,2,2-三氟乙酰胺
The XLogP value of 4.4 indicates that N-(4-丁基苯基)-2,2,2-三氟乙酰胺 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, N-(4-丁基苯基)-2,2,2-三氟乙酰胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(4-丁基苯基)-2,2,2-三氟乙酰胺 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 N-(4-丁基苯基)-2,2,2-三氟乙酰胺?
The CAS number of N-(4-丁基苯基)-2,2,2-三氟乙酰胺 is 448250-66-6.
What is the molecular formula of N-(4-丁基苯基)-2,2,2-三氟乙酰胺?
The molecular formula of N-(4-丁基苯基)-2,2,2-三氟乙酰胺 is C12H14F3NO.
What is the molecular weight of N-(4-丁基苯基)-2,2,2-三氟乙酰胺?
The molecular weight of N-(4-丁基苯基)-2,2,2-三氟乙酰胺 is 245.10 g/mol.
Where can I buy N-(4-丁基苯基)-2,2,2-三氟乙酰胺?
You can request a quote for N-(4-丁基苯基)-2,2,2-三氟乙酰胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-丁基苯基)-2,2,2-三氟乙酰胺?
Yes, KEHONG BIO provides custom synthesis services for N-(4-丁基苯基)-2,2,2-三氟乙酰胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.