2-[(4-methoxy-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl)methyl-(2-methylsulfonyloxyethyl)amino]ethyl methanesulfonate
TL;DR: 2-[(4-methoxy-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl)methyl-(2-methylsulfonyloxyethyl)amino]ethyl methanesulfonate (CAS 54946-43-9) is a chemical compound with molecular formula C15H29NO10S2 and molecular weight 447.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-methoxy-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl)methyl-(2-methylsulfonyloxyethyl)amino]ethyl methanesulfonate
Also Known As: 2-[(4-methoxy-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl)methyl-(2-methylsulfonyloxyethyl)amino]ethyl methanesulfonate, Methyl 5-(bis{2-[(methanesulfonyl)oxy]ethyl}amino)-5-deoxy-2,3-O-(1-methylethylidene)pentofuranoside
| Molecular Formula | C15H29NO10S2 |
|---|---|
| Molecular Weight | 447.12 g/mol |
| LogP | -0.9 |
| Topological Polar Surface Area | 144.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 11 |
| Exact Mass | 447.1233 |
| Heavy Atoms | 28 |
| Complexity | 674.0 |
Chemical Identifiers
| CAS Number | 54946-43-9 |
|---|---|
| SMILES | CC1(OC2C(OC(C2O1)OC)CN(CCOS(=O)(=O)C)CCOS(=O)(=O)C)C |
| InChIKey | JJSXGMBOWBCYLG-UHFFFAOYSA-N |
Product Overview
2-[(4-methoxy-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl)methyl-(2-methylsulfonyloxyethyl)amino]ethyl methanesulfonate (CAS 54946-43-9), with molecular formula C15H29NO10S2 and molecular weight 447.12 g/mol. IUPAC: 2-[(4-methoxy-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl)methyl-(2-methylsulfonyloxyethyl)amino]ethyl methanesulfonate.
Chemical Property Profile of 2-[(4-methoxy-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl)methyl-(2-methylsulfonyloxyethyl)amino]ethyl methanesulfonate
Property Insights of 2-[(4-methoxy-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl)methyl-(2-methylsulfonyloxyethyl)amino]ethyl methanesulfonate
The XLogP value of -0.9 indicates that 2-[(4-methoxy-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl)methyl-(2-methylsulfonyloxyethyl)amino]ethyl methanesulfonate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 144.0 Ų indicates high polarity, suggesting 2-[(4-methoxy-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl)methyl-(2-methylsulfonyloxyethyl)amino]ethyl methanesulfonate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-[(4-methoxy-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl)methyl-(2-methylsulfonyloxyethyl)amino]ethyl methanesulfonate has 0 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-[(4-methoxy-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl)methyl-(2-methylsulfonyloxyethyl)amino]ethyl methanesulfonate?
The CAS number of 2-[(4-methoxy-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl)methyl-(2-methylsulfonyloxyethyl)amino]ethyl methanesulfonate is 54946-43-9.
What is the molecular formula of 2-[(4-methoxy-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl)methyl-(2-methylsulfonyloxyethyl)amino]ethyl methanesulfonate?
The molecular formula of 2-[(4-methoxy-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl)methyl-(2-methylsulfonyloxyethyl)amino]ethyl methanesulfonate is C15H29NO10S2.
What is the molecular weight of 2-[(4-methoxy-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl)methyl-(2-methylsulfonyloxyethyl)amino]ethyl methanesulfonate?
The molecular weight of 2-[(4-methoxy-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl)methyl-(2-methylsulfonyloxyethyl)amino]ethyl methanesulfonate is 447.12 g/mol.
Where can I buy 2-[(4-methoxy-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl)methyl-(2-methylsulfonyloxyethyl)amino]ethyl methanesulfonate?
You can request a quote for 2-[(4-methoxy-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl)methyl-(2-methylsulfonyloxyethyl)amino]ethyl methanesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(4-methoxy-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl)methyl-(2-methylsulfonyloxyethyl)amino]ethyl methanesulfonate?
Yes, KEHONG BIO provides custom synthesis services for 2-[(4-methoxy-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl)methyl-(2-methylsulfonyloxyethyl)amino]ethyl methanesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.