Benzylamine, N-(2-chloroethyl)-N-phenoxyethyl-, hydrochloride
TL;DR: Benzylamine, N-(2-chloroethyl)-N-phenoxyethyl-, hydrochloride (CAS 32414-28-1) is a chemical compound with molecular formula C17H21Cl2NO and molecular weight 325.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl-(2-chloroethyl)-(2-phenoxyethyl)azanium chloride
Also Known As: N-(2-Chloroethyl)-N-phenoxyethylbenzylamine hydrochloride, Benzylamine, N-(2-chloroethyl)-N-(2-phenoxyethyl)-, hydrochloride, BENZYLAMINE, N-(2-CHLOROETHYL)-N-PHENOXYETHYL-, HYDROCHLORIDE, Benzenemethanamine, N-(2-chloroethyl)-N-(2-phenoxyethyl)-, hydrochloride, benzyl-(2-chloroethyl)-(2-phenoxyethyl)azanium chloride
| Molecular Formula | C17H21Cl2NO |
|---|---|
| Molecular Weight | 325.10 g/mol |
| LogP | -0.61 |
| Topological Polar Surface Area | 13.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 8 |
| Exact Mass | 325.1 |
| Heavy Atoms | 21 |
| Complexity | 237.0 |
Chemical Identifiers
| CAS Number | 32414-28-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)C[NH+](CCOC2=CC=CC=C2)CCCl.[Cl-] |
| InChIKey | FRHWGEORUKRDBY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzylamine, N-(2-chloroethyl)-N-phenoxyethyl-, hydrochloride (CAS 32414-28-1), with molecular formula C17H21Cl2NO and molecular weight 325.10 g/mol. IUPAC: benzyl-(2-chloroethyl)-(2-phenoxyethyl)azanium chloride.
Chemical Property Profile of Benzylamine, N-(2-chloroethyl)-N-phenoxyethyl-, hydrochloride
Property Insights of Benzylamine, N-(2-chloroethyl)-N-phenoxyethyl-, hydrochloride
The XLogP value of -0.61 indicates that Benzylamine, N-(2-chloroethyl)-N-phenoxyethyl-, 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-phenoxyethyl-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzylamine, N-(2-chloroethyl)-N-phenoxyethyl-, 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-phenoxyethyl-, hydrochloride?
The CAS number of Benzylamine, N-(2-chloroethyl)-N-phenoxyethyl-, hydrochloride is 32414-28-1.
What is the molecular formula of Benzylamine, N-(2-chloroethyl)-N-phenoxyethyl-, hydrochloride?
The molecular formula of Benzylamine, N-(2-chloroethyl)-N-phenoxyethyl-, hydrochloride is C17H21Cl2NO.
What is the molecular weight of Benzylamine, N-(2-chloroethyl)-N-phenoxyethyl-, hydrochloride?
The molecular weight of Benzylamine, N-(2-chloroethyl)-N-phenoxyethyl-, hydrochloride is 325.10 g/mol.
Where can I buy Benzylamine, N-(2-chloroethyl)-N-phenoxyethyl-, hydrochloride?
You can request a quote for Benzylamine, N-(2-chloroethyl)-N-phenoxyethyl-, 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-phenoxyethyl-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Benzylamine, N-(2-chloroethyl)-N-phenoxyethyl-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.