1-Oxyl-2,2,5,5-tetramethyl-3-(methanesulfonyloxymethyl)pyrroline
TL;DR: 1-Oxyl-2,2,5,5-tetramethyl-3-(methanesulfonyloxymethyl)pyrroline (CAS 76893-27-1) is a chemical compound with molecular formula C10H18NO4S- and molecular weight 248.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,2,5,5-tetramethyl-1-oxidopyrrol-3-yl)methyl methanesulfonate
Also Known As: 1-Oxyl-2,2,5,5-tetramethyl-3-(methanesulfonyloxymethyl)pyrroline, C10H18NO4S-, (2,2,5,5-tetramethyl-1-oxidopyrrol-3-yl)methyl methanesulfonate, (2,2,5,5-tetramethyl-1-oxido-pyrrol-3-yl)methyl methanesulfonate, 2,2,5,5-tetramethyl-3-(methylsulfonyloxymethyl)-1-oxido-pyrrole
| Molecular Formula | C10H18NO4S- |
|---|---|
| Molecular Weight | 248.10 g/mol |
| LogP | 1.2596 |
| Topological Polar Surface Area | 69.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 248.09566 |
| Heavy Atoms | 16 |
| Complexity | 408.53497 |
Chemical Identifiers
| CAS Number | 76893-27-1 |
|---|---|
| SMILES | CC1(C=C(C(N1[O-])(C)C)COS(=O)(=O)C)C |
Product Overview
1-Oxyl-2,2,5,5-tetramethyl-3-(methanesulfonyloxymethyl)pyrroline (CAS 76893-27-1), with molecular formula C10H18NO4S- and molecular weight 248.10 g/mol. IUPAC: (2,2,5,5-tetramethyl-1-oxidopyrrol-3-yl)methyl methanesulfonate.
Chemical Property Profile of 1-Oxyl-2,2,5,5-tetramethyl-3-(methanesulfonyloxymethyl)pyrroline
Property Insights of 1-Oxyl-2,2,5,5-tetramethyl-3-(methanesulfonyloxymethyl)pyrroline
The XLogP value of 1.2596 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Oxyl-2,2,5,5-tetramethyl-3-(methanesulfonyloxymethyl)pyrroline. The TPSA of 69.67 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Oxyl-2,2,5,5-tetramethyl-3-(methanesulfonyloxymethyl)pyrroline. Following Lipinski's Rule of Five, 1-Oxyl-2,2,5,5-tetramethyl-3-(methanesulfonyloxymethyl)pyrroline has 0 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-Oxyl-2,2,5,5-tetramethyl-3-(methanesulfonyloxymethyl)pyrroline?
The CAS number of 1-Oxyl-2,2,5,5-tetramethyl-3-(methanesulfonyloxymethyl)pyrroline is 76893-27-1.
What is the molecular formula of 1-Oxyl-2,2,5,5-tetramethyl-3-(methanesulfonyloxymethyl)pyrroline?
The molecular formula of 1-Oxyl-2,2,5,5-tetramethyl-3-(methanesulfonyloxymethyl)pyrroline is C10H18NO4S-.
What is the molecular weight of 1-Oxyl-2,2,5,5-tetramethyl-3-(methanesulfonyloxymethyl)pyrroline?
The molecular weight of 1-Oxyl-2,2,5,5-tetramethyl-3-(methanesulfonyloxymethyl)pyrroline is 248.10 g/mol.
Where can I buy 1-Oxyl-2,2,5,5-tetramethyl-3-(methanesulfonyloxymethyl)pyrroline?
You can request a quote for 1-Oxyl-2,2,5,5-tetramethyl-3-(methanesulfonyloxymethyl)pyrroline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Oxyl-2,2,5,5-tetramethyl-3-(methanesulfonyloxymethyl)pyrroline?
Yes, KEHONG BIO provides custom synthesis services for 1-Oxyl-2,2,5,5-tetramethyl-3-(methanesulfonyloxymethyl)pyrroline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.