Butanedioic acid, 2-((dimethoxyphosphinothioyl)thio)-, 1,4-dimethyl ester
TL;DR: Butanedioic acid, 2-((dimethoxyphosphinothioyl)thio)-, 1,4-dimethyl ester (CAS 3700-89-8) is a chemical compound with molecular formula C8H15O6PS2 and molecular weight 302.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 2-dimethoxyphosphinothioylsulfanylbutanedioate
Also Known As: O,O-Dimethyl malathion, Carbomethoxy malathion, Take 20, O,O-Dimethylmalathion, Carbisopropoxy malaoxon
| Molecular Formula | C8H15O6PS2 |
|---|---|
| Molecular Weight | 302.00 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 128.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 302.00476 |
| Heavy Atoms | 17 |
| Complexity | 313.0 |
Chemical Identifiers
| CAS Number | 3700-89-8 |
|---|---|
| SMILES | COC(=O)CC(C(=O)OC)SP(=S)(OC)OC |
| InChIKey | GADZSMZOQMSZDT-UHFFFAOYSA-N |
Product Overview
Butanedioic acid, 2-((dimethoxyphosphinothioyl)thio)-, 1,4-dimethyl ester (CAS 3700-89-8), with molecular formula C8H15O6PS2 and molecular weight 302.00 g/mol. IUPAC: dimethyl 2-dimethoxyphosphinothioylsulfanylbutanedioate.
Chemical Property Profile of Butanedioic acid, 2-((dimethoxyphosphinothioyl)thio)-, 1,4-dimethyl ester
Property Insights of Butanedioic acid, 2-((dimethoxyphosphinothioyl)thio)-, 1,4-dimethyl ester
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Butanedioic acid, 2-((dimethoxyphosphinothioyl)thio)-, 1,4-dimethyl ester. The TPSA of 128.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Butanedioic acid, 2-((dimethoxyphosphinothioyl)thio)-, 1,4-dimethyl ester. Following Lipinski's Rule of Five, Butanedioic acid, 2-((dimethoxyphosphinothioyl)thio)-, 1,4-dimethyl ester has 0 hydrogen bond donor(s) and 8 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 Butanedioic acid, 2-((dimethoxyphosphinothioyl)thio)-, 1,4-dimethyl ester?
The CAS number of Butanedioic acid, 2-((dimethoxyphosphinothioyl)thio)-, 1,4-dimethyl ester is 3700-89-8.
What is the molecular formula of Butanedioic acid, 2-((dimethoxyphosphinothioyl)thio)-, 1,4-dimethyl ester?
The molecular formula of Butanedioic acid, 2-((dimethoxyphosphinothioyl)thio)-, 1,4-dimethyl ester is C8H15O6PS2.
What is the molecular weight of Butanedioic acid, 2-((dimethoxyphosphinothioyl)thio)-, 1,4-dimethyl ester?
The molecular weight of Butanedioic acid, 2-((dimethoxyphosphinothioyl)thio)-, 1,4-dimethyl ester is 302.00 g/mol.
Where can I buy Butanedioic acid, 2-((dimethoxyphosphinothioyl)thio)-, 1,4-dimethyl ester?
You can request a quote for Butanedioic acid, 2-((dimethoxyphosphinothioyl)thio)-, 1,4-dimethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butanedioic acid, 2-((dimethoxyphosphinothioyl)thio)-, 1,4-dimethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Butanedioic acid, 2-((dimethoxyphosphinothioyl)thio)-, 1,4-dimethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.