N-cyclopentyl-4-nitroaniline
TL;DR: N-cyclopentyl-4-nitroaniline (CAS 342044-45-5) is a chemical compound with molecular formula C11H14N2O2 and molecular weight 206.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-cyclopentyl-4-nitroaniline
Also Known As: N-cyclopentyl-4-nitroaniline, N-cyclopentyl-4-nitro-aniline, AE-562/12222432, 998-202-5, RefChem:829647
| Molecular Formula | C11H14N2O2 |
|---|---|
| Molecular Weight | 206.11 g/mol |
| LogP | 2.9493 |
| Topological Polar Surface Area | 55.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 206.10553 |
| Heavy Atoms | 15 |
| Complexity | 342.11047 |
Chemical Identifiers
| CAS Number | 342044-45-5 |
|---|---|
| SMILES | C1CCC(C1)NC2=CC=C(C=C2)[N+](=O)[O-] |
Product Overview
N-cyclopentyl-4-nitroaniline (CAS 342044-45-5), with molecular formula C11H14N2O2 and molecular weight 206.11 g/mol. IUPAC: N-cyclopentyl-4-nitroaniline.
Chemical Property Profile of N-cyclopentyl-4-nitroaniline
Property Insights of N-cyclopentyl-4-nitroaniline
The XLogP value of 2.9493 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-cyclopentyl-4-nitroaniline. With a topological polar surface area (TPSA) of 55.17 Ų, N-cyclopentyl-4-nitroaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-cyclopentyl-4-nitroaniline 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 N-cyclopentyl-4-nitroaniline?
The CAS number of N-cyclopentyl-4-nitroaniline is 342044-45-5.
What is the molecular formula of N-cyclopentyl-4-nitroaniline?
The molecular formula of N-cyclopentyl-4-nitroaniline is C11H14N2O2.
What is the molecular weight of N-cyclopentyl-4-nitroaniline?
The molecular weight of N-cyclopentyl-4-nitroaniline is 206.11 g/mol.
Where can I buy N-cyclopentyl-4-nitroaniline?
You can request a quote for N-cyclopentyl-4-nitroaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-cyclopentyl-4-nitroaniline?
Yes, KEHONG BIO provides custom synthesis services for N-cyclopentyl-4-nitroaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.