Methyl-ethyl-beta-chloroethylamine hydrochloride
TL;DR: Methyl-ethyl-beta-chloroethylamine hydrochloride (CAS 4535-88-0) is a chemical compound with molecular formula C5H13Cl2N and molecular weight 157.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloroethyl-ethyl-methylazanium chloride
Also Known As: Methyl-ethyl-beta-chloroethylamine hydrochloride, 2-Chloro-N-methyldiethylamine hydrochloride, 2-chloroethyl-ethyl-methylazanium;chloride, 2-chloroethyl-ethyl-methylazanium chloride, DIETHYLAMINE, 2-CHLORO-N-METHYL-, HYDROCHLORIDE
| Molecular Formula | C5H13Cl2N |
|---|---|
| Molecular Weight | 157.04 g/mol |
| LogP | -3.24 |
| Topological Polar Surface Area | 4.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 157.04251 |
| Heavy Atoms | 8 |
| Complexity | 39.0 |
Chemical Identifiers
| CAS Number | 4535-88-0 |
|---|---|
| SMILES | CC[NH+](C)CCCl.[Cl-] |
| InChIKey | JNZADWSFSFZFLJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methyl-ethyl-beta-chloroethylamine hydrochloride (CAS 4535-88-0), with molecular formula C5H13Cl2N and molecular weight 157.04 g/mol. IUPAC: 2-chloroethyl-ethyl-methylazanium chloride.
Chemical Property Profile of Methyl-ethyl-beta-chloroethylamine hydrochloride
Property Insights of Methyl-ethyl-beta-chloroethylamine hydrochloride
The XLogP value of -3.24 indicates that Methyl-ethyl-beta-chloroethylamine hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 4.4 Ų, Methyl-ethyl-beta-chloroethylamine hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl-ethyl-beta-chloroethylamine 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 Methyl-ethyl-beta-chloroethylamine hydrochloride?
The CAS number of Methyl-ethyl-beta-chloroethylamine hydrochloride is 4535-88-0.
What is the molecular formula of Methyl-ethyl-beta-chloroethylamine hydrochloride?
The molecular formula of Methyl-ethyl-beta-chloroethylamine hydrochloride is C5H13Cl2N.
What is the molecular weight of Methyl-ethyl-beta-chloroethylamine hydrochloride?
The molecular weight of Methyl-ethyl-beta-chloroethylamine hydrochloride is 157.04 g/mol.
Where can I buy Methyl-ethyl-beta-chloroethylamine hydrochloride?
You can request a quote for Methyl-ethyl-beta-chloroethylamine hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl-ethyl-beta-chloroethylamine hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Methyl-ethyl-beta-chloroethylamine hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.