Dimethyl propan-2-yl phosphorotetrathioate
TL;DR: Dimethyl propan-2-yl phosphorotetrathioate (CAS 5446-61-7) is a chemical compound with molecular formula C5H13PS4 and molecular weight 231.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(methylsulfanyl)-propan-2-ylsulfanyl-sulfanylidene-λ5-phosphane
Also Known As: dimethyl propan-2-yl phosphorotetrathioate, Butanedioic acid,2-hydroxy-2-methyl-,ion(2-), Tetrathiophosphorsaeure-isopropylester-dimethylester, bis(methylsulfanyl)-propan-2-ylsulfanyl-sulfanylidene-, BUTANEDIOIC ACID,2-HYDROXY-2-METHYL-, ION(2-)
| Molecular Formula | C5H13PS4 |
|---|---|
| Molecular Weight | 231.96 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 108.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 231.96378 |
| Heavy Atoms | 10 |
| Complexity | 126.0 |
Chemical Identifiers
| CAS Number | 5446-61-7 |
|---|---|
| SMILES | CC(C)SP(=S)(SC)SC |
| InChIKey | ASJWFCKCKBDIES-UHFFFAOYSA-N |
Product Overview
Dimethyl propan-2-yl phosphorotetrathioate (CAS 5446-61-7), with molecular formula C5H13PS4 and molecular weight 231.96 g/mol. IUPAC: bis(methylsulfanyl)-propan-2-ylsulfanyl-sulfanylidene-λ5-phosphane.
Chemical Property Profile of Dimethyl propan-2-yl phosphorotetrathioate
Property Insights of Dimethyl propan-2-yl phosphorotetrathioate
The XLogP value of 3.2 indicates that Dimethyl propan-2-yl phosphorotetrathioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 108.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Dimethyl propan-2-yl phosphorotetrathioate. Following Lipinski's Rule of Five, Dimethyl propan-2-yl phosphorotetrathioate has 0 hydrogen bond donor(s) and 4 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 Dimethyl propan-2-yl phosphorotetrathioate?
The CAS number of Dimethyl propan-2-yl phosphorotetrathioate is 5446-61-7.
What is the molecular formula of Dimethyl propan-2-yl phosphorotetrathioate?
The molecular formula of Dimethyl propan-2-yl phosphorotetrathioate is C5H13PS4.
What is the molecular weight of Dimethyl propan-2-yl phosphorotetrathioate?
The molecular weight of Dimethyl propan-2-yl phosphorotetrathioate is 231.96 g/mol.
Where can I buy Dimethyl propan-2-yl phosphorotetrathioate?
You can request a quote for Dimethyl propan-2-yl phosphorotetrathioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethyl propan-2-yl phosphorotetrathioate?
Yes, KEHONG BIO provides custom synthesis services for Dimethyl propan-2-yl phosphorotetrathioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.