2-Methyl-5-trimethylammoniummethyl-1,3-oxathiolane
TL;DR: 2-Methyl-5-trimethylammoniummethyl-1,3-oxathiolane (CAS 76541-57-6) is a chemical compound with molecular formula C8H18INOS and molecular weight 303.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trimethyl-[(2-methyl-1,3-oxathiolan-5-yl)methyl]azanium iodide
Also Known As: Oxa 22, 2-Methyl-5-trimethylammoniummethyl-1,3-oxathiolane, cis-2-Methyl-5-trimethylammoniummethyl-1,3-oxathiolane iodide, 1,3-Oxathiolane-5-methanaminium, N,N,N,2-tetramethyl-, iodide, cis-2-methyl-5-dimethylaminomethyl-1,3-oxathiolane methiodide
| Molecular Formula | C8H18INOS |
|---|---|
| Molecular Weight | 303.02 g/mol |
| LogP | -1.8254 |
| Topological Polar Surface Area | 34.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 303.01538 |
| Heavy Atoms | 12 |
| Complexity | 133.0 |
Chemical Identifiers
| CAS Number | 76541-57-6 |
|---|---|
| SMILES | CC1OC(CS1)C[N+](C)(C)C.[I-] |
| InChIKey | TWNAKQKXXMGYQT-UHFFFAOYSA-M |
Product Overview
2-Methyl-5-trimethylammoniummethyl-1,3-oxathiolane (CAS 76541-57-6), with molecular formula C8H18INOS and molecular weight 303.02 g/mol. IUPAC: trimethyl-[(2-methyl-1,3-oxathiolan-5-yl)methyl]azanium iodide.
Chemical Property Profile of 2-Methyl-5-trimethylammoniummethyl-1,3-oxathiolane
Property Insights of 2-Methyl-5-trimethylammoniummethyl-1,3-oxathiolane
The XLogP value of -1.8254 indicates that 2-Methyl-5-trimethylammoniummethyl-1,3-oxathiolane is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 34.5 Ų, 2-Methyl-5-trimethylammoniummethyl-1,3-oxathiolane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methyl-5-trimethylammoniummethyl-1,3-oxathiolane has 0 hydrogen bond donor(s) and 3 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 2-Methyl-5-trimethylammoniummethyl-1,3-oxathiolane?
The CAS number of 2-Methyl-5-trimethylammoniummethyl-1,3-oxathiolane is 76541-57-6.
What is the molecular formula of 2-Methyl-5-trimethylammoniummethyl-1,3-oxathiolane?
The molecular formula of 2-Methyl-5-trimethylammoniummethyl-1,3-oxathiolane is C8H18INOS.
What is the molecular weight of 2-Methyl-5-trimethylammoniummethyl-1,3-oxathiolane?
The molecular weight of 2-Methyl-5-trimethylammoniummethyl-1,3-oxathiolane is 303.02 g/mol.
Where can I buy 2-Methyl-5-trimethylammoniummethyl-1,3-oxathiolane?
You can request a quote for 2-Methyl-5-trimethylammoniummethyl-1,3-oxathiolane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methyl-5-trimethylammoniummethyl-1,3-oxathiolane?
Yes, KEHONG BIO provides custom synthesis services for 2-Methyl-5-trimethylammoniummethyl-1,3-oxathiolane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.