4-Ethoxy-3-fluoro-N,N-dimethyl-beta-(1-methylpropyl)benzeneethanamine
TL;DR: 4-Ethoxy-3-fluoro-N,N-dimethyl-beta-(1-methylpropyl)benzeneethanamine (CAS 3346-78-9) is a chemical compound with molecular formula C16H26FNO and molecular weight 267.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-ethoxy-3-fluorophenyl)-N,N,3-trimethylpentan-1-amine
Also Known As: beta-sec-Butyl-N,N-dimethyl-4-ethoxy-3-fluorophenethylamine, 2-(4-ethoxy-3-fluorophenyl)-n,n,3-trimethylpentan-1-amine, Phenethylamine, beta-(sec-butyl)-N,N-dimethyl-4-ethoxy-3-fluoro-, 4-Ethoxy-3-fluoro-N,N-dimethyl-beta-(1-methylpropyl)benzeneethanamine, [2-(4-ethoxy-3-fluorophenyl)-3-methylpentyl]dimethylamine
| Molecular Formula | C16H26FNO |
|---|---|
| Molecular Weight | 267.20 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 12.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 267.19983 |
| Heavy Atoms | 19 |
| Complexity | 247.0 |
Chemical Identifiers
| CAS Number | 3346-78-9 |
|---|---|
| SMILES | CCC(C)C(CN(C)C)C1=CC(=C(C=C1)OCC)F |
| InChIKey | ITYOSSYGTWUQNH-UHFFFAOYSA-N |
Product Overview
4-Ethoxy-3-fluoro-N,N-dimethyl-beta-(1-methylpropyl)benzeneethanamine (CAS 3346-78-9), with molecular formula C16H26FNO and molecular weight 267.20 g/mol. IUPAC: 2-(4-ethoxy-3-fluorophenyl)-N,N,3-trimethylpentan-1-amine.
Chemical Property Profile of 4-Ethoxy-3-fluoro-N,N-dimethyl-beta-(1-methylpropyl)benzeneethanamine
Property Insights of 4-Ethoxy-3-fluoro-N,N-dimethyl-beta-(1-methylpropyl)benzeneethanamine
The XLogP value of 4.3 indicates that 4-Ethoxy-3-fluoro-N,N-dimethyl-beta-(1-methylpropyl)benzeneethanamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.5 Ų, 4-Ethoxy-3-fluoro-N,N-dimethyl-beta-(1-methylpropyl)benzeneethanamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Ethoxy-3-fluoro-N,N-dimethyl-beta-(1-methylpropyl)benzeneethanamine 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 4-Ethoxy-3-fluoro-N,N-dimethyl-beta-(1-methylpropyl)benzeneethanamine?
The CAS number of 4-Ethoxy-3-fluoro-N,N-dimethyl-beta-(1-methylpropyl)benzeneethanamine is 3346-78-9.
What is the molecular formula of 4-Ethoxy-3-fluoro-N,N-dimethyl-beta-(1-methylpropyl)benzeneethanamine?
The molecular formula of 4-Ethoxy-3-fluoro-N,N-dimethyl-beta-(1-methylpropyl)benzeneethanamine is C16H26FNO.
What is the molecular weight of 4-Ethoxy-3-fluoro-N,N-dimethyl-beta-(1-methylpropyl)benzeneethanamine?
The molecular weight of 4-Ethoxy-3-fluoro-N,N-dimethyl-beta-(1-methylpropyl)benzeneethanamine is 267.20 g/mol.
Where can I buy 4-Ethoxy-3-fluoro-N,N-dimethyl-beta-(1-methylpropyl)benzeneethanamine?
You can request a quote for 4-Ethoxy-3-fluoro-N,N-dimethyl-beta-(1-methylpropyl)benzeneethanamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Ethoxy-3-fluoro-N,N-dimethyl-beta-(1-methylpropyl)benzeneethanamine?
Yes, KEHONG BIO provides custom synthesis services for 4-Ethoxy-3-fluoro-N,N-dimethyl-beta-(1-methylpropyl)benzeneethanamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.