![2-[4-[2-Nitro-4-(trifluoromethyl)phenyl]piperazino]-1-ethanol structure](/static/products/3306/330633-81-3.webp)
2-[4-[2-Nitro-4-(trifluoromethyl)phenyl]piperazino]-1-ethanol
TL;DR: 2-[4-[2-Nitro-4-(trifluoromethyl)phenyl]piperazino]-1-ethanol (CAS 330633-81-3) is a chemical compound with molecular formula C13H16F3N3O3 and molecular weight 319.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]ethanol
Also Known As: 2-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazino]-1-ethanol, 2-Pyrazoline,1-methyl-4-propyl, BUTTPARK 153\33-69, BAS 00805355, nitrotrifluoromethylphenylpiperazinoethanol
| Molecular Formula | C13H16F3N3O3 |
|---|---|
| Molecular Weight | 319.11 g/mol |
| LogP | 1.7279 |
| Topological Polar Surface Area | 69.85 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 319.11438 |
| Heavy Atoms | 22 |
| Complexity | 543.06726 |
Chemical Identifiers
| CAS Number | 330633-81-3 |
|---|---|
| SMILES | C1CN(CCN1CCO)C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-] |
Product Overview
2-[4-[2-Nitro-4-(trifluoromethyl)phenyl]piperazino]-1-ethanol (CAS 330633-81-3), with molecular formula C13H16F3N3O3 and molecular weight 319.11 g/mol. IUPAC: 2-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]ethanol.
Chemical Property Profile of 2-[4-[2-Nitro-4-(trifluoromethyl)phenyl]piperazino]-1-ethanol
Property Insights of 2-[4-[2-Nitro-4-(trifluoromethyl)phenyl]piperazino]-1-ethanol
The XLogP value of 1.7279 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[4-[2-Nitro-4-(trifluoromethyl)phenyl]piperazino]-1-ethanol. The TPSA of 69.85 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[4-[2-Nitro-4-(trifluoromethyl)phenyl]piperazino]-1-ethanol. Following Lipinski's Rule of Five, 2-[4-[2-Nitro-4-(trifluoromethyl)phenyl]piperazino]-1-ethanol has 1 hydrogen bond donor(s) and 5 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-[4-[2-Nitro-4-(trifluoromethyl)phenyl]piperazino]-1-ethanol?
The CAS number of 2-[4-[2-Nitro-4-(trifluoromethyl)phenyl]piperazino]-1-ethanol is 330633-81-3.
What is the molecular formula of 2-[4-[2-Nitro-4-(trifluoromethyl)phenyl]piperazino]-1-ethanol?
The molecular formula of 2-[4-[2-Nitro-4-(trifluoromethyl)phenyl]piperazino]-1-ethanol is C13H16F3N3O3.
What is the molecular weight of 2-[4-[2-Nitro-4-(trifluoromethyl)phenyl]piperazino]-1-ethanol?
The molecular weight of 2-[4-[2-Nitro-4-(trifluoromethyl)phenyl]piperazino]-1-ethanol is 319.11 g/mol.
Where can I buy 2-[4-[2-Nitro-4-(trifluoromethyl)phenyl]piperazino]-1-ethanol?
You can request a quote for 2-[4-[2-Nitro-4-(trifluoromethyl)phenyl]piperazino]-1-ethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[4-[2-Nitro-4-(trifluoromethyl)phenyl]piperazino]-1-ethanol?
Yes, KEHONG BIO provides custom synthesis services for 2-[4-[2-Nitro-4-(trifluoromethyl)phenyl]piperazino]-1-ethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.