C10H9Cl4O3PS
TL;DR: C10H9Cl4O3PS (CAS 83619-81-2) is a chemical compound with molecular formula C10H9Cl4O3PS and molecular weight 379.88 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4-dichloro-1-[2,2-dichloro-1-[methoxy(methylsulfanyl)phosphoryl]oxyethenyl]benzene
Also Known As: Phosphorothioic acid, O-(2,2-dichloro-1-(2,4-dichlorophenyl)ethenyl) O,S-dimethyl ester, 2,4-dichloro-1-[2,2-dichloro-1-[methoxy(methylsulfanyl)phosphoryl]oxyethenyl]benzene, O-[2,2-Dichloro-1-(2,4-dichlorophenyl)ethen-1-yl] O,S-dimethyl phosphorothioate, O-[2,2-dichloro-1-(2,4-dichlorophenyl)ethenyl] O,S-dimethyl phosphorothioate
| Molecular Formula | C10H9Cl4O3PS |
|---|---|
| Molecular Weight | 379.88 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 60.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 379.8764 |
| Heavy Atoms | 19 |
| Complexity | 389.0 |
Chemical Identifiers
| CAS Number | 83619-81-2 |
|---|---|
| SMILES | COP(=O)(OC(=C(Cl)Cl)C1=C(C=C(C=C1)Cl)Cl)SC |
| InChIKey | PRKXYTSRQSABAV-UHFFFAOYSA-N |
Product Overview
C10H9Cl4O3PS (CAS 83619-81-2), with molecular formula C10H9Cl4O3PS and molecular weight 379.88 g/mol. IUPAC: 2,4-dichloro-1-[2,2-dichloro-1-[methoxy(methylsulfanyl)phosphoryl]oxyethenyl]benzene.
Chemical Property Profile of C10H9Cl4O3PS
Property Insights of C10H9Cl4O3PS
The XLogP value of 4.7 indicates that C10H9Cl4O3PS is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.8 Ų falls within the moderate polarity range, balancing permeability and solubility for C10H9Cl4O3PS. Following Lipinski's Rule of Five, C10H9Cl4O3PS 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 C10H9Cl4O3PS?
The CAS number of C10H9Cl4O3PS is 83619-81-2.
What is the molecular formula of C10H9Cl4O3PS?
The molecular formula of C10H9Cl4O3PS is C10H9Cl4O3PS.
What is the molecular weight of C10H9Cl4O3PS?
The molecular weight of C10H9Cl4O3PS is 379.88 g/mol.
Where can I buy C10H9Cl4O3PS?
You can request a quote for C10H9Cl4O3PS directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C10H9Cl4O3PS?
Yes, KEHONG BIO provides custom synthesis services for C10H9Cl4O3PS and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.