![1-[2-Nitro-4-(trifluoromethyl)phenyl]pyrrolidine structure](/static/products/4083/40832-82-4.webp)
1-[2-Nitro-4-(trifluoromethyl)phenyl]pyrrolidine
TL;DR: 1-[2-Nitro-4-(trifluoromethyl)phenyl]pyrrolidine (CAS 40832-82-4) is a chemical compound with molecular formula C11H11F3N2O2 and molecular weight 260.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-nitro-4-(trifluoromethyl)phenyl]pyrrolidine
Also Known As: N-[2-Nitro-4-(trifluoromethyl)phenyl]pyrrolidine, 1-[2-nitro-4-(trifluoromethyl)phenyl]pyrrolidine, Maybridge1_000622, 1-(2-nitro-4-(trifluoromethyl)phenyl)pyrrolidine, 3-Nitro-4-(1-pyrrolidino)benzotrifluoride
| Molecular Formula | C11H11F3N2O2 |
|---|---|
| Molecular Weight | 260.08 g/mol |
| LogP | 3.2138 |
| Topological Polar Surface Area | 46.38 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 260.07727 |
| Heavy Atoms | 18 |
| Complexity | 467.8464 |
Chemical Identifiers
| CAS Number | 40832-82-4 |
|---|---|
| SMILES | C1CCN(C1)C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-] |
Product Overview
1-[2-Nitro-4-(trifluoromethyl)phenyl]pyrrolidine (CAS 40832-82-4), with molecular formula C11H11F3N2O2 and molecular weight 260.08 g/mol. IUPAC: 1-[2-nitro-4-(trifluoromethyl)phenyl]pyrrolidine.
Chemical Property Profile of 1-[2-Nitro-4-(trifluoromethyl)phenyl]pyrrolidine
Property Insights of 1-[2-Nitro-4-(trifluoromethyl)phenyl]pyrrolidine
The XLogP value of 3.2138 indicates that 1-[2-Nitro-4-(trifluoromethyl)phenyl]pyrrolidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.38 Ų, 1-[2-Nitro-4-(trifluoromethyl)phenyl]pyrrolidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[2-Nitro-4-(trifluoromethyl)phenyl]pyrrolidine has 0 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 1-[2-Nitro-4-(trifluoromethyl)phenyl]pyrrolidine?
The CAS number of 1-[2-Nitro-4-(trifluoromethyl)phenyl]pyrrolidine is 40832-82-4.
What is the molecular formula of 1-[2-Nitro-4-(trifluoromethyl)phenyl]pyrrolidine?
The molecular formula of 1-[2-Nitro-4-(trifluoromethyl)phenyl]pyrrolidine is C11H11F3N2O2.
What is the molecular weight of 1-[2-Nitro-4-(trifluoromethyl)phenyl]pyrrolidine?
The molecular weight of 1-[2-Nitro-4-(trifluoromethyl)phenyl]pyrrolidine is 260.08 g/mol.
Where can I buy 1-[2-Nitro-4-(trifluoromethyl)phenyl]pyrrolidine?
You can request a quote for 1-[2-Nitro-4-(trifluoromethyl)phenyl]pyrrolidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[2-Nitro-4-(trifluoromethyl)phenyl]pyrrolidine?
Yes, KEHONG BIO provides custom synthesis services for 1-[2-Nitro-4-(trifluoromethyl)phenyl]pyrrolidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.