2-Methyl-2-triphenylphosphaniumylpropanedithioate
TL;DR: 2-Methyl-2-triphenylphosphaniumylpropanedithioate (CAS 69491-12-9) is a chemical compound with molecular formula C22H21PS2 and molecular weight 380.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-2-triphenylphosphaniumylpropanedithioate
Also Known As: 2-methyl-2-triphenylphosphaniumylpropanedithioate, 2-methyl-2-triphenylphosphaniumyl-propanedithioate, 2-Methyl-2-(triphenylphosphaniumyl)propane(dithioate), RefChem:263175
| Molecular Formula | C22H21PS2 |
|---|---|
| Molecular Weight | 380.08 g/mol |
| LogP | 4.6334 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 380.08224 |
| Heavy Atoms | 25 |
| Complexity | 746.3063 |
Chemical Identifiers
| CAS Number | 69491-12-9 |
|---|---|
| SMILES | CC(C)(C(=S)[S-])[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3 |
Product Overview
2-Methyl-2-triphenylphosphaniumylpropanedithioate (CAS 69491-12-9), with molecular formula C22H21PS2 and molecular weight 380.08 g/mol. IUPAC: 2-methyl-2-triphenylphosphaniumylpropanedithioate.
Chemical Property Profile of 2-Methyl-2-triphenylphosphaniumylpropanedithioate
Property Insights of 2-Methyl-2-triphenylphosphaniumylpropanedithioate
The XLogP value of 4.6334 indicates that 2-Methyl-2-triphenylphosphaniumylpropanedithioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 2-Methyl-2-triphenylphosphaniumylpropanedithioate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methyl-2-triphenylphosphaniumylpropanedithioate has 0 hydrogen bond donor(s) and 2 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-2-triphenylphosphaniumylpropanedithioate?
The CAS number of 2-Methyl-2-triphenylphosphaniumylpropanedithioate is 69491-12-9.
What is the molecular formula of 2-Methyl-2-triphenylphosphaniumylpropanedithioate?
The molecular formula of 2-Methyl-2-triphenylphosphaniumylpropanedithioate is C22H21PS2.
What is the molecular weight of 2-Methyl-2-triphenylphosphaniumylpropanedithioate?
The molecular weight of 2-Methyl-2-triphenylphosphaniumylpropanedithioate is 380.08 g/mol.
Where can I buy 2-Methyl-2-triphenylphosphaniumylpropanedithioate?
You can request a quote for 2-Methyl-2-triphenylphosphaniumylpropanedithioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methyl-2-triphenylphosphaniumylpropanedithioate?
Yes, KEHONG BIO provides custom synthesis services for 2-Methyl-2-triphenylphosphaniumylpropanedithioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.