N-(2-Chloroethyl)benzylamine hydrochloride
TL;DR: N-(2-Chloroethyl)benzylamine hydrochloride (CAS 6288-63-7) is a chemical compound with molecular formula C9H13Cl2N and molecular weight 205.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl(2-chloroethyl)azanium chloride
Also Known As: N-(2-Chloroethyl)benzylamine hydrochloride, benzyl(2-chloroethyl)azanium chloride, benzyl(2-chloroethyl)azanium;chloride, N-Benzyl-N-(2-chloroethyl)amine hydrochloride, Benzenemethanamine, N-(2-chloroethyl)-, hydrochloride
| Molecular Formula | C9H13Cl2N |
|---|---|
| Molecular Weight | 205.04 g/mol |
| LogP | -2.01 |
| Topological Polar Surface Area | 16.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 205.04251 |
| Heavy Atoms | 12 |
| Complexity | 89.0 |
Chemical Identifiers
| CAS Number | 6288-63-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)C[NH2+]CCCl.[Cl-] |
| InChIKey | RAJZCNAPSJZGBF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-(2-Chloroethyl)benzylamine hydrochloride (CAS 6288-63-7), with molecular formula C9H13Cl2N and molecular weight 205.04 g/mol. IUPAC: benzyl(2-chloroethyl)azanium chloride.
Chemical Property Profile of N-(2-Chloroethyl)benzylamine hydrochloride
Property Insights of N-(2-Chloroethyl)benzylamine hydrochloride
The XLogP value of -2.01 indicates that N-(2-Chloroethyl)benzylamine hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 16.6 Ų, N-(2-Chloroethyl)benzylamine hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(2-Chloroethyl)benzylamine hydrochloride 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 N-(2-Chloroethyl)benzylamine hydrochloride?
The CAS number of N-(2-Chloroethyl)benzylamine hydrochloride is 6288-63-7.
What is the molecular formula of N-(2-Chloroethyl)benzylamine hydrochloride?
The molecular formula of N-(2-Chloroethyl)benzylamine hydrochloride is C9H13Cl2N.
What is the molecular weight of N-(2-Chloroethyl)benzylamine hydrochloride?
The molecular weight of N-(2-Chloroethyl)benzylamine hydrochloride is 205.04 g/mol.
Where can I buy N-(2-Chloroethyl)benzylamine hydrochloride?
You can request a quote for N-(2-Chloroethyl)benzylamine hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-Chloroethyl)benzylamine hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for N-(2-Chloroethyl)benzylamine hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.