Demethyl dichlorvos
TL;DR: Demethyl dichlorvos (CAS 17650-82-7) is a chemical compound with molecular formula C2H3Cl2O4P and molecular weight 191.91 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2-dichloroethenyl dihydrogen phosphate
Also Known As: Demethyl dichlorvos, Trichlorfon metabolite, Dichlorovinyl phosphate, Dichlorvos, demethyl deriv., dichlorovinylphosphoric acid
| Molecular Formula | C2H3Cl2O4P |
|---|---|
| Molecular Weight | 191.91 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 66.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 191.9146 |
| Heavy Atoms | 9 |
| Complexity | 156.0 |
Chemical Identifiers
| CAS Number | 17650-82-7 |
|---|---|
| SMILES | C(=C(Cl)Cl)OP(=O)(O)O |
| InChIKey | MNRWIFMPVCLIDS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Demethyl dichlorvos (CAS 17650-82-7), with molecular formula C2H3Cl2O4P and molecular weight 191.91 g/mol. IUPAC: 2,2-dichloroethenyl dihydrogen phosphate.
Chemical Property Profile of Demethyl dichlorvos
Property Insights of Demethyl dichlorvos
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Demethyl dichlorvos. The TPSA of 66.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Demethyl dichlorvos. Following Lipinski's Rule of Five, Demethyl dichlorvos has 2 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 Demethyl dichlorvos?
The CAS number of Demethyl dichlorvos is 17650-82-7.
What is the molecular formula of Demethyl dichlorvos?
The molecular formula of Demethyl dichlorvos is C2H3Cl2O4P.
What is the molecular weight of Demethyl dichlorvos?
The molecular weight of Demethyl dichlorvos is 191.91 g/mol.
Where can I buy Demethyl dichlorvos?
You can request a quote for Demethyl dichlorvos directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Demethyl dichlorvos?
Yes, KEHONG BIO provides custom synthesis services for Demethyl dichlorvos and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.