1-Hexanol, 6-((2-hydroxyethyl)amino)-, diethanesulfonate (ester), hydrochloride
TL;DR: 1-Hexanol, 6-((2-hydroxyethyl)amino)-, diethanesulfonate (ester), hydrochloride (CAS 61556-92-1) is a chemical compound with molecular formula C12H28ClNO6S2 and molecular weight 381.10464 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-ethylsulfonyloxyethyl(6-ethylsulfonyloxyhexyl)azanium chloride
Also Known As: 6-((2-Hydroxyethyl)amino)-1-hexanol diethanesulfonate hydrochloride, 2-ethylsulfonyloxyethyl(6-ethylsulfonyloxyhexyl)azanium chloride, 1-HEXANOL, 6-((2-HYDROXYETHYL)AMINO)-, DIETHANESULFONATE (ester), HYDROCHLORIDE
Technical Specifications
| Molecular Formula | C12H28ClNO6S2 |
| Molecular Weight | 381.10464 g/mol |
| XLogP | -3.15 |
| Topological Polar Surface Area (TPSA) | 120.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 14 |
| Exact Mass | 381.10464 Da |
| Heavy Atoms | 22 |
| Complexity | 435.0 |
| SMILES | CCS(=O)(=O)OCCCCCC[NH2+]CCOS(=O)(=O)CC.[Cl-] |
| InChIKey | PSNUUGIGXJKHNE-UHFFFAOYSA-N |
Chemical Property Profile of 1-Hexanol, 6-((2-hydroxyethyl)amino)-, diethanesulfonate (ester), hydrochloride
Property Insights of 1-Hexanol, 6-((2-hydroxyethyl)amino)-, diethanesulfonate (ester), hydrochloride
The XLogP value of -3.15 indicates that 1-Hexanol, 6-((2-hydroxyethyl)amino)-, diethanesulfonate (ester), hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 120.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Hexanol, 6-((2-hydroxyethyl)amino)-, diethanesulfonate (ester), hydrochloride. Following Lipinski's Rule of Five, 1-Hexanol, 6-((2-hydroxyethyl)amino)-, diethanesulfonate (ester), hydrochloride has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-Hexanol, 6-((2-hydroxyethyl)amino)-, diethanesulfonate (ester), hydrochloride?
The CAS number of 1-Hexanol, 6-((2-hydroxyethyl)amino)-, diethanesulfonate (ester), hydrochloride is 61556-92-1.
What is the molecular formula of 1-Hexanol, 6-((2-hydroxyethyl)amino)-, diethanesulfonate (ester), hydrochloride?
The molecular formula of 1-Hexanol, 6-((2-hydroxyethyl)amino)-, diethanesulfonate (ester), hydrochloride is C12H28ClNO6S2.
What is the molecular weight of 1-Hexanol, 6-((2-hydroxyethyl)amino)-, diethanesulfonate (ester), hydrochloride?
The molecular weight of 1-Hexanol, 6-((2-hydroxyethyl)amino)-, diethanesulfonate (ester), hydrochloride is 381.10464 g/mol.
Where can I buy 1-Hexanol, 6-((2-hydroxyethyl)amino)-, diethanesulfonate (ester), hydrochloride?
You can request a quote for 1-Hexanol, 6-((2-hydroxyethyl)amino)-, diethanesulfonate (ester), hydrochloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-Hexanol, 6-((2-hydroxyethyl)amino)-, diethanesulfonate (ester), hydrochloride?
Yes, CoreyChem provides custom synthesis services for 1-Hexanol, 6-((2-hydroxyethyl)amino)-, diethanesulfonate (ester), hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.