![n-Butyl-n-[2-(4-nitrophenyl)ethyl]butan-1-amine structure](/static/products/5339/5339-00-4.webp)
n-Butyl-n-[2-(4-nitrophenyl)ethyl]butan-1-amine
TL;DR: n-Butyl-n-[2-(4-nitrophenyl)ethyl]butan-1-amine (CAS 5339-00-4) is a chemical compound with molecular formula C16H26N2O2 and molecular weight 278.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-butyl-N-[2-(4-nitrophenyl)ethyl]butan-1-amine
Also Known As: 4-nitrophenethyldibutylamine, n-butyl-n-[2-(4-nitrophenyl)ethyl]butan-1-amine, N-butyl-N-[2-(4-nitrophenyl)ethyl]-1-butanamine
| Molecular Formula | C16H26N2O2 |
|---|---|
| Molecular Weight | 278.20 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 49.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 9 |
| Exact Mass | 278.19943 |
| Heavy Atoms | 20 |
| Complexity | 250.0 |
Chemical Identifiers
| CAS Number | 5339-00-4 |
|---|---|
| SMILES | CCCCN(CCCC)CCC1=CC=C(C=C1)[N+](=O)[O-] |
| InChIKey | BDYHHTQXTLRPRK-UHFFFAOYSA-N |
Product Overview
n-Butyl-n-[2-(4-nitrophenyl)ethyl]butan-1-amine (CAS 5339-00-4), with molecular formula C16H26N2O2 and molecular weight 278.20 g/mol. IUPAC: N-butyl-N-[2-(4-nitrophenyl)ethyl]butan-1-amine.
Chemical Property Profile of n-Butyl-n-[2-(4-nitrophenyl)ethyl]butan-1-amine
Property Insights of n-Butyl-n-[2-(4-nitrophenyl)ethyl]butan-1-amine
The XLogP value of 4.7 indicates that n-Butyl-n-[2-(4-nitrophenyl)ethyl]butan-1-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.1 Ų, n-Butyl-n-[2-(4-nitrophenyl)ethyl]butan-1-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, n-Butyl-n-[2-(4-nitrophenyl)ethyl]butan-1-amine 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 n-Butyl-n-[2-(4-nitrophenyl)ethyl]butan-1-amine?
The CAS number of n-Butyl-n-[2-(4-nitrophenyl)ethyl]butan-1-amine is 5339-00-4.
What is the molecular formula of n-Butyl-n-[2-(4-nitrophenyl)ethyl]butan-1-amine?
The molecular formula of n-Butyl-n-[2-(4-nitrophenyl)ethyl]butan-1-amine is C16H26N2O2.
What is the molecular weight of n-Butyl-n-[2-(4-nitrophenyl)ethyl]butan-1-amine?
The molecular weight of n-Butyl-n-[2-(4-nitrophenyl)ethyl]butan-1-amine is 278.20 g/mol.
Where can I buy n-Butyl-n-[2-(4-nitrophenyl)ethyl]butan-1-amine?
You can request a quote for n-Butyl-n-[2-(4-nitrophenyl)ethyl]butan-1-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for n-Butyl-n-[2-(4-nitrophenyl)ethyl]butan-1-amine?
Yes, KEHONG BIO provides custom synthesis services for n-Butyl-n-[2-(4-nitrophenyl)ethyl]butan-1-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.