![N-[4-chloro-2-(trifluoromethyl)phenyl]-3-oxobutanamide structure](/static/products/802/80277-90-3.png)
N-[4-chloro-2-(trifluoromethyl)phenyl]-3-oxobutanamide
TL;DR: N-[4-chloro-2-(trifluoromethyl)phenyl]-3-oxobutanamide (CAS 80277-90-3) is a chemical compound with molecular formula C11H9ClF3NO2 and molecular weight 279.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-chloro-2-(trifluoromethyl)phenyl]-3-oxobutanamide
Also Known As: N-[4-chloro-2-(trifluoromethyl)phenyl]-3-oxobutanamide, N-(4-Chloro-2-(trifluoromethyl)phenyl)-3-oxobutanamide
| Molecular Formula | C11H9ClF3NO2 |
|---|---|
| Molecular Weight | 279.03 g/mol |
| LogP | 3.2764 |
| Topological Polar Surface Area | 46.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 279.0274 |
| Heavy Atoms | 18 |
| Complexity | 485.66693 |
Chemical Identifiers
| CAS Number | 80277-90-3 |
|---|---|
| SMILES | CC(=O)CC(=O)NC1=C(C=C(C=C1)Cl)C(F)(F)F |
Product Overview
N-[4-chloro-2-(trifluoromethyl)phenyl]-3-oxobutanamide (CAS 80277-90-3), with molecular formula C11H9ClF3NO2 and molecular weight 279.03 g/mol. IUPAC: N-[4-chloro-2-(trifluoromethyl)phenyl]-3-oxobutanamide.
Chemical Property Profile of N-[4-chloro-2-(trifluoromethyl)phenyl]-3-oxobutanamide
Property Insights of N-[4-chloro-2-(trifluoromethyl)phenyl]-3-oxobutanamide
The XLogP value of 3.2764 indicates that N-[4-chloro-2-(trifluoromethyl)phenyl]-3-oxobutanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.17 Ų, N-[4-chloro-2-(trifluoromethyl)phenyl]-3-oxobutanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[4-chloro-2-(trifluoromethyl)phenyl]-3-oxobutanamide has 1 hydrogen bond donor(s) and 2 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-chloro-2-(trifluoromethyl)phenyl]-3-oxobutanamide?
The CAS number of N-[4-chloro-2-(trifluoromethyl)phenyl]-3-oxobutanamide is 80277-90-3.
What is the molecular formula of N-[4-chloro-2-(trifluoromethyl)phenyl]-3-oxobutanamide?
The molecular formula of N-[4-chloro-2-(trifluoromethyl)phenyl]-3-oxobutanamide is C11H9ClF3NO2.
What is the molecular weight of N-[4-chloro-2-(trifluoromethyl)phenyl]-3-oxobutanamide?
The molecular weight of N-[4-chloro-2-(trifluoromethyl)phenyl]-3-oxobutanamide is 279.03 g/mol.
Where can I buy N-[4-chloro-2-(trifluoromethyl)phenyl]-3-oxobutanamide?
You can request a quote for N-[4-chloro-2-(trifluoromethyl)phenyl]-3-oxobutanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[4-chloro-2-(trifluoromethyl)phenyl]-3-oxobutanamide?
Yes, KEHONG BIO provides custom synthesis services for N-[4-chloro-2-(trifluoromethyl)phenyl]-3-oxobutanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.