![5-Nitro-6-[4-(trifluoromethyl)phenyl]piperidin-2-one structure](/static/products/4304/430449-32-4.webp)
5-Nitro-6-[4-(trifluoromethyl)phenyl]piperidin-2-one
TL;DR: 5-Nitro-6-[4-(trifluoromethyl)phenyl]piperidin-2-one (CAS 430449-32-4) is a chemical compound with molecular formula C12H11F3N2O3 and molecular weight 288.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-nitro-6-[4-(trifluoromethyl)phenyl]piperidin-2-one
Also Known As: 5-nitro-6-[4-(trifluoromethyl)phenyl]piperidin-2-one, BAS 04378713, 5-Nitro-6-(4-trifluoromethyl-phenyl)-piperidin-2-one, A2618/0111334
| Molecular Formula | C12H11F3N2O3 |
|---|---|
| Molecular Weight | 288.07 g/mol |
| LogP | 2.3018 |
| Topological Polar Surface Area | 72.24 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 288.07217 |
| Heavy Atoms | 20 |
| Complexity | 527.74426 |
Chemical Identifiers
| CAS Number | 430449-32-4 |
|---|---|
| SMILES | C1CC(=O)NC(C1[N+](=O)[O-])C2=CC=C(C=C2)C(F)(F)F |
Product Overview
5-Nitro-6-[4-(trifluoromethyl)phenyl]piperidin-2-one (CAS 430449-32-4), with molecular formula C12H11F3N2O3 and molecular weight 288.07 g/mol. IUPAC: 5-nitro-6-[4-(trifluoromethyl)phenyl]piperidin-2-one.
Chemical Property Profile of 5-Nitro-6-[4-(trifluoromethyl)phenyl]piperidin-2-one
Property Insights of 5-Nitro-6-[4-(trifluoromethyl)phenyl]piperidin-2-one
The XLogP value of 2.3018 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Nitro-6-[4-(trifluoromethyl)phenyl]piperidin-2-one. The TPSA of 72.24 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Nitro-6-[4-(trifluoromethyl)phenyl]piperidin-2-one. Following Lipinski's Rule of Five, 5-Nitro-6-[4-(trifluoromethyl)phenyl]piperidin-2-one has 1 hydrogen bond donor(s) and 3 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 5-Nitro-6-[4-(trifluoromethyl)phenyl]piperidin-2-one?
The CAS number of 5-Nitro-6-[4-(trifluoromethyl)phenyl]piperidin-2-one is 430449-32-4.
What is the molecular formula of 5-Nitro-6-[4-(trifluoromethyl)phenyl]piperidin-2-one?
The molecular formula of 5-Nitro-6-[4-(trifluoromethyl)phenyl]piperidin-2-one is C12H11F3N2O3.
What is the molecular weight of 5-Nitro-6-[4-(trifluoromethyl)phenyl]piperidin-2-one?
The molecular weight of 5-Nitro-6-[4-(trifluoromethyl)phenyl]piperidin-2-one is 288.07 g/mol.
Where can I buy 5-Nitro-6-[4-(trifluoromethyl)phenyl]piperidin-2-one?
You can request a quote for 5-Nitro-6-[4-(trifluoromethyl)phenyl]piperidin-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Nitro-6-[4-(trifluoromethyl)phenyl]piperidin-2-one?
Yes, KEHONG BIO provides custom synthesis services for 5-Nitro-6-[4-(trifluoromethyl)phenyl]piperidin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.