Benzeneethanamine, N,N-dibutyl-, hydrochloride (1:1)
TL;DR: Benzeneethanamine, N,N-dibutyl-, hydrochloride (1:1) (CAS 14180-18-8) is a chemical compound with molecular formula C16H28ClN and molecular weight 269.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-butyl-N-(2-phenylethyl)butan-1-amine;hydrochloride
Also Known As: Benzeneethanamine, N,N-dibutyl-, hydrochloride, N,N-Dibutylphenethylamine hydrochloride, N,N-dibutylphenethylaminehydrochloride, dibutyl(2-phenylethyl)amine hydrochloride, 2-Fluoro-3-trifluoromethylbenzylcyanide
| Molecular Formula | C16H28ClN |
|---|---|
| Molecular Weight | 269.19 g/mol |
| LogP | 4.55 |
| Topological Polar Surface Area | 3.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 9 |
| Exact Mass | 269.19104 |
| Heavy Atoms | 18 |
| Complexity | 153.0 |
Chemical Identifiers
| CAS Number | 14180-18-8 |
|---|---|
| SMILES | CCCCN(CCCC)CCC1=CC=CC=C1.Cl |
| InChIKey | OAUFZDJROJSXGE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzeneethanamine, N,N-dibutyl-, hydrochloride (1:1) (CAS 14180-18-8), with molecular formula C16H28ClN and molecular weight 269.19 g/mol. IUPAC: N-butyl-N-(2-phenylethyl)butan-1-amine;hydrochloride.
Chemical Property Profile of Benzeneethanamine, N,N-dibutyl-, hydrochloride (1:1)
Property Insights of Benzeneethanamine, N,N-dibutyl-, hydrochloride (1:1)
The XLogP value of 4.55 indicates that Benzeneethanamine, N,N-dibutyl-, hydrochloride (1:1) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.2 Ų, Benzeneethanamine, N,N-dibutyl-, hydrochloride (1:1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzeneethanamine, N,N-dibutyl-, hydrochloride (1:1) has 1 hydrogen bond donor(s) and 1 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 Benzeneethanamine, N,N-dibutyl-, hydrochloride (1:1)?
The CAS number of Benzeneethanamine, N,N-dibutyl-, hydrochloride (1:1) is 14180-18-8.
What is the molecular formula of Benzeneethanamine, N,N-dibutyl-, hydrochloride (1:1)?
The molecular formula of Benzeneethanamine, N,N-dibutyl-, hydrochloride (1:1) is C16H28ClN.
What is the molecular weight of Benzeneethanamine, N,N-dibutyl-, hydrochloride (1:1)?
The molecular weight of Benzeneethanamine, N,N-dibutyl-, hydrochloride (1:1) is 269.19 g/mol.
Where can I buy Benzeneethanamine, N,N-dibutyl-, hydrochloride (1:1)?
You can request a quote for Benzeneethanamine, N,N-dibutyl-, hydrochloride (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzeneethanamine, N,N-dibutyl-, hydrochloride (1:1)?
Yes, KEHONG BIO provides custom synthesis services for Benzeneethanamine, N,N-dibutyl-, hydrochloride (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.