1,1,1-Tris(methanesulfonyloxymethyl)propane
TL;DR: 1,1,1-Tris(methanesulfonyloxymethyl)propane (CAS 17388-84-0) is a chemical compound with molecular formula C9H20O9S3 and molecular weight 368.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2-bis(methylsulfonyloxymethyl)butyl methanesulfonate
Also Known As: 1,1,1-Tris(methanesulfonyloxymethyl)propane, 1,1-Tris(methanesulfonyloxymethyl)propane, 2,2-bis{[(methylsulfonyl)oxy]methyl}butyl methanesulfonate, Tris(methanesulfonyloxymethyl)propane, 1,1,1-, 1, 2-ethyl-2-(hydroxymethyl)-, trimethanesulfonate
| Molecular Formula | C9H20O9S3 |
|---|---|
| Molecular Weight | 368.03 g/mol |
| LogP | -0.5 |
| Topological Polar Surface Area | 155.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 10 |
| Exact Mass | 368.02695 |
| Heavy Atoms | 21 |
| Complexity | 525.0 |
Chemical Identifiers
| CAS Number | 17388-84-0 |
|---|---|
| SMILES | CCC(COS(=O)(=O)C)(COS(=O)(=O)C)COS(=O)(=O)C |
| InChIKey | WOXAMMSGNUZZEV-UHFFFAOYSA-N |
Product Overview
1,1,1-Tris(methanesulfonyloxymethyl)propane (CAS 17388-84-0), with molecular formula C9H20O9S3 and molecular weight 368.03 g/mol. IUPAC: 2,2-bis(methylsulfonyloxymethyl)butyl methanesulfonate.
Chemical Property Profile of 1,1,1-Tris(methanesulfonyloxymethyl)propane
Property Insights of 1,1,1-Tris(methanesulfonyloxymethyl)propane
The XLogP value of -0.5 indicates that 1,1,1-Tris(methanesulfonyloxymethyl)propane is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 155.0 Ų indicates high polarity, suggesting 1,1,1-Tris(methanesulfonyloxymethyl)propane may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1,1,1-Tris(methanesulfonyloxymethyl)propane has 0 hydrogen bond donor(s) and 9 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 1,1,1-Tris(methanesulfonyloxymethyl)propane?
The CAS number of 1,1,1-Tris(methanesulfonyloxymethyl)propane is 17388-84-0.
What is the molecular formula of 1,1,1-Tris(methanesulfonyloxymethyl)propane?
The molecular formula of 1,1,1-Tris(methanesulfonyloxymethyl)propane is C9H20O9S3.
What is the molecular weight of 1,1,1-Tris(methanesulfonyloxymethyl)propane?
The molecular weight of 1,1,1-Tris(methanesulfonyloxymethyl)propane is 368.03 g/mol.
Where can I buy 1,1,1-Tris(methanesulfonyloxymethyl)propane?
You can request a quote for 1,1,1-Tris(methanesulfonyloxymethyl)propane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1,1-Tris(methanesulfonyloxymethyl)propane?
Yes, KEHONG BIO provides custom synthesis services for 1,1,1-Tris(methanesulfonyloxymethyl)propane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.