Dimethoate carboxylic acid
TL;DR: Dimethoate carboxylic acid (CAS 1113-01-5) is a chemical compound with molecular formula C4H9O4PS2 and molecular weight 215.96799 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-dimethoxyphosphinothioylsulfanylacetic acid
Also Known As: Dimethoate carboxylic acid, Carboxy derivative of dimethoate, Carboxyderivativeofdimethoate, 2-dimethoxyphosphinothioylsulfanylacetic acid, Phosphorodithioic acid, O,O-dimethyl S-carboxymethyl ester
Technical Specifications
| Molecular Formula | C4H9O4PS2 |
| Molecular Weight | 215.96799 g/mol |
| XLogP | 1.0 |
| Topological Polar Surface Area (TPSA) | 113.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 215.96799 Da |
| Heavy Atoms | 11 |
| Complexity | 175.0 |
| SMILES | COP(=S)(OC)SCC(=O)O |
| InChIKey | OGCAJUKWNJKZFV-UHFFFAOYSA-N |
Chemical Property Profile of Dimethoate carboxylic acid
Property Insights of Dimethoate carboxylic acid
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dimethoate carboxylic acid. The TPSA of 113.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Dimethoate carboxylic acid. Following Lipinski's Rule of Five, Dimethoate carboxylic acid has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Dimethoate carboxylic acid?
The CAS number of Dimethoate carboxylic acid is 1113-01-5.
What is the molecular formula of Dimethoate carboxylic acid?
The molecular formula of Dimethoate carboxylic acid is C4H9O4PS2.
What is the molecular weight of Dimethoate carboxylic acid?
The molecular weight of Dimethoate carboxylic acid is 215.96799 g/mol.
Where can I buy Dimethoate carboxylic acid?
You can request a quote for Dimethoate carboxylic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Dimethoate carboxylic acid?
Yes, CoreyChem provides custom synthesis services for Dimethoate carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.