Benzylamine, N-(2-chloroethyl)-N-(2-ethylphenoxyethyl)-, hydrochloride
TL;DR: Benzylamine, N-(2-chloroethyl)-N-(2-ethylphenoxyethyl)-, hydrochloride (CAS 63991-08-2) is a chemical compound with molecular formula C19H25Cl2NO and molecular weight 353.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl-(2-chloroethyl)-[2-(2-ethylphenoxy)ethyl]azanium chloride
Also Known As: BENZYLAMINE, N-(2-CHLOROETHYL)-N-(2-ETHYLPHENOXYETHYL)-, HYDROCHLORIDE, N-(2-Chloroethyl)-N-(2-(o-ethylphenoxy)ethyl)benzylamine hydrochloride, benzyl-(2-chloroethyl)-[2-(2-ethylphenoxy)ethyl]azanium chloride, Benzenemethanamine, N-(2-chloroethyl)-N-[2-(2-ethylphenoxy)ethyl]-, hydrochloride, RefChem:1079504
| Molecular Formula | C19H25Cl2NO |
|---|---|
| Molecular Weight | 353.13 g/mol |
| LogP | -0.04 |
| Topological Polar Surface Area | 13.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 9 |
| Exact Mass | 353.13132 |
| Heavy Atoms | 23 |
| Complexity | 281.0 |
Chemical Identifiers
| CAS Number | 63991-08-2 |
|---|---|
| SMILES | CCC1=CC=CC=C1OCC[NH+](CCCl)CC2=CC=CC=C2.[Cl-] |
| InChIKey | DSEYHMSMHVUVLX-UHFFFAOYSA-N |
Product Overview
Benzylamine, N-(2-chloroethyl)-N-(2-ethylphenoxyethyl)-, hydrochloride (CAS 63991-08-2), with molecular formula C19H25Cl2NO and molecular weight 353.13 g/mol. IUPAC: benzyl-(2-chloroethyl)-[2-(2-ethylphenoxy)ethyl]azanium chloride.
Chemical Property Profile of Benzylamine, N-(2-chloroethyl)-N-(2-ethylphenoxyethyl)-, hydrochloride
Property Insights of Benzylamine, N-(2-chloroethyl)-N-(2-ethylphenoxyethyl)-, hydrochloride
The XLogP value of -0.04 indicates that Benzylamine, N-(2-chloroethyl)-N-(2-ethylphenoxyethyl)-, hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 13.7 Ų, Benzylamine, N-(2-chloroethyl)-N-(2-ethylphenoxyethyl)-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzylamine, N-(2-chloroethyl)-N-(2-ethylphenoxyethyl)-, hydrochloride has 1 hydrogen bond donor(s) and 2 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 Benzylamine, N-(2-chloroethyl)-N-(2-ethylphenoxyethyl)-, hydrochloride?
The CAS number of Benzylamine, N-(2-chloroethyl)-N-(2-ethylphenoxyethyl)-, hydrochloride is 63991-08-2.
What is the molecular formula of Benzylamine, N-(2-chloroethyl)-N-(2-ethylphenoxyethyl)-, hydrochloride?
The molecular formula of Benzylamine, N-(2-chloroethyl)-N-(2-ethylphenoxyethyl)-, hydrochloride is C19H25Cl2NO.
What is the molecular weight of Benzylamine, N-(2-chloroethyl)-N-(2-ethylphenoxyethyl)-, hydrochloride?
The molecular weight of Benzylamine, N-(2-chloroethyl)-N-(2-ethylphenoxyethyl)-, hydrochloride is 353.13 g/mol.
Where can I buy Benzylamine, N-(2-chloroethyl)-N-(2-ethylphenoxyethyl)-, hydrochloride?
You can request a quote for Benzylamine, N-(2-chloroethyl)-N-(2-ethylphenoxyethyl)-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzylamine, N-(2-chloroethyl)-N-(2-ethylphenoxyethyl)-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Benzylamine, N-(2-chloroethyl)-N-(2-ethylphenoxyethyl)-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.