N-Benzyl-2-chloro-N-(2-ethoxyethyl)ethanamine
TL;DR: N-Benzyl-2-chloro-N-(2-ethoxyethyl)ethanamine (CAS 6336-90-9) is a chemical compound with molecular formula C13H20ClNO and molecular weight 241.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-benzyl-N-(2-chloroethyl)-2-ethoxyethanamine
Also Known As: 6-hydroxy-5,12-tetracene-5,12-dione, N-benzyl-N-(2-chloroethyl)-2-ethoxyethanamine, N-BENZYL-2-CHLORO-N-(2-ETHOXYETHYL)ETHANAMINE, N-Benzyl-2-chloro-N-(2-ethoxyethyl)ethan-1-amine
| Molecular Formula | C13H20ClNO |
|---|---|
| Molecular Weight | 241.12 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 12.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 8 |
| Exact Mass | 241.12334 |
| Heavy Atoms | 16 |
| Complexity | 160.0 |
Chemical Identifiers
| CAS Number | 6336-90-9 |
|---|---|
| SMILES | CCOCCN(CCCl)CC1=CC=CC=C1 |
| InChIKey | IHVCRKSDSUJVFG-UHFFFAOYSA-N |
Product Overview
N-Benzyl-2-chloro-N-(2-ethoxyethyl)ethanamine (CAS 6336-90-9), with molecular formula C13H20ClNO and molecular weight 241.12 g/mol. IUPAC: N-benzyl-N-(2-chloroethyl)-2-ethoxyethanamine.
Chemical Property Profile of N-Benzyl-2-chloro-N-(2-ethoxyethyl)ethanamine
Property Insights of N-Benzyl-2-chloro-N-(2-ethoxyethyl)ethanamine
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Benzyl-2-chloro-N-(2-ethoxyethyl)ethanamine. With a topological polar surface area (TPSA) of 12.5 Ų, N-Benzyl-2-chloro-N-(2-ethoxyethyl)ethanamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-Benzyl-2-chloro-N-(2-ethoxyethyl)ethanamine has 0 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 N-Benzyl-2-chloro-N-(2-ethoxyethyl)ethanamine?
The CAS number of N-Benzyl-2-chloro-N-(2-ethoxyethyl)ethanamine is 6336-90-9.
What is the molecular formula of N-Benzyl-2-chloro-N-(2-ethoxyethyl)ethanamine?
The molecular formula of N-Benzyl-2-chloro-N-(2-ethoxyethyl)ethanamine is C13H20ClNO.
What is the molecular weight of N-Benzyl-2-chloro-N-(2-ethoxyethyl)ethanamine?
The molecular weight of N-Benzyl-2-chloro-N-(2-ethoxyethyl)ethanamine is 241.12 g/mol.
Where can I buy N-Benzyl-2-chloro-N-(2-ethoxyethyl)ethanamine?
You can request a quote for N-Benzyl-2-chloro-N-(2-ethoxyethyl)ethanamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Benzyl-2-chloro-N-(2-ethoxyethyl)ethanamine?
Yes, KEHONG BIO provides custom synthesis services for N-Benzyl-2-chloro-N-(2-ethoxyethyl)ethanamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.