1-Hexylamine, 6-chloro-N-ethyl-N-(2-(2,6-xylyloxy)ethyl)-, oxalate
TL;DR: 1-Hexylamine, 6-chloro-N-ethyl-N-(2-(2,6-xylyloxy)ethyl)-, oxalate (CAS 42055-01-6) is a chemical compound with molecular formula C20H32ClNO5 and molecular weight 401.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chlorohexyl-[2-(2,6-dimethylphenoxy)ethyl]-ethylazanium;2-hydroxy-2-oxoacetate
Also Known As: 6-Chloro-N-ethyl-N-(2-(2,6-xylyloxy)ethyl)-1-hexylamine oxalate, 1-HEXYLAMINE, 6-CHLORO-N-ETHYL-N-(2-(2,6-XYLYLOXY)ETHYL)-, OXALATE, 5-bromo-N-[2-(2,6-dimethylphenoxy)ethyl]-N-ethylpentan-1-amine, 6-Chloro-N-[2-(2,6-dimethylphenoxy)ethyl]-N-ethyl-1-hexanaminium hydrogen oxalate, 6-chlorohexyl-[2-(2,6-dimethylphenoxy)ethyl]-ethylazanium; 2-hydroxy-2-oxoacetate
| Molecular Formula | C20H32ClNO5 |
|---|---|
| Molecular Weight | 401.20 g/mol |
| LogP | 1.21 |
| Topological Polar Surface Area | 91.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 11 |
| Exact Mass | 401.1969 |
| Heavy Atoms | 27 |
| Complexity | 317.0 |
Chemical Identifiers
| CAS Number | 42055-01-6 |
|---|---|
| SMILES | CC[NH+](CCCCCCCl)CCOC1=C(C=CC=C1C)C.C(=O)(C(=O)[O-])O |
| InChIKey | GTQTWHIXNAHIAU-UHFFFAOYSA-N |
Product Overview
1-Hexylamine, 6-chloro-N-ethyl-N-(2-(2,6-xylyloxy)ethyl)-, oxalate (CAS 42055-01-6), with molecular formula C20H32ClNO5 and molecular weight 401.20 g/mol. IUPAC: 6-chlorohexyl-[2-(2,6-dimethylphenoxy)ethyl]-ethylazanium;2-hydroxy-2-oxoacetate.
Chemical Property Profile of 1-Hexylamine, 6-chloro-N-ethyl-N-(2-(2,6-xylyloxy)ethyl)-, oxalate
Property Insights of 1-Hexylamine, 6-chloro-N-ethyl-N-(2-(2,6-xylyloxy)ethyl)-, oxalate
The XLogP value of 1.21 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Hexylamine, 6-chloro-N-ethyl-N-(2-(2,6-xylyloxy)ethyl)-, oxalate. The TPSA of 91.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Hexylamine, 6-chloro-N-ethyl-N-(2-(2,6-xylyloxy)ethyl)-, oxalate. Following Lipinski's Rule of Five, 1-Hexylamine, 6-chloro-N-ethyl-N-(2-(2,6-xylyloxy)ethyl)-, oxalate has 2 hydrogen bond donor(s) and 5 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 1-Hexylamine, 6-chloro-N-ethyl-N-(2-(2,6-xylyloxy)ethyl)-, oxalate?
The CAS number of 1-Hexylamine, 6-chloro-N-ethyl-N-(2-(2,6-xylyloxy)ethyl)-, oxalate is 42055-01-6.
What is the molecular formula of 1-Hexylamine, 6-chloro-N-ethyl-N-(2-(2,6-xylyloxy)ethyl)-, oxalate?
The molecular formula of 1-Hexylamine, 6-chloro-N-ethyl-N-(2-(2,6-xylyloxy)ethyl)-, oxalate is C20H32ClNO5.
What is the molecular weight of 1-Hexylamine, 6-chloro-N-ethyl-N-(2-(2,6-xylyloxy)ethyl)-, oxalate?
The molecular weight of 1-Hexylamine, 6-chloro-N-ethyl-N-(2-(2,6-xylyloxy)ethyl)-, oxalate is 401.20 g/mol.
Where can I buy 1-Hexylamine, 6-chloro-N-ethyl-N-(2-(2,6-xylyloxy)ethyl)-, oxalate?
You can request a quote for 1-Hexylamine, 6-chloro-N-ethyl-N-(2-(2,6-xylyloxy)ethyl)-, oxalate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Hexylamine, 6-chloro-N-ethyl-N-(2-(2,6-xylyloxy)ethyl)-, oxalate?
Yes, KEHONG BIO provides custom synthesis services for 1-Hexylamine, 6-chloro-N-ethyl-N-(2-(2,6-xylyloxy)ethyl)-, oxalate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.