Dithicrofos
TL;DR: Dithicrofos (CAS 5367-88-4) is a chemical compound with molecular formula C13H18ClO2PS3 and molecular weight 367.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6-chloro-3,4-dihydro-2H-thiochromen-4-yl)sulfanyl-diethoxy-sulfanylidene-λ5-phosphane
Also Known As: Dithicrofos, Dithicrofos [ISO], 6-Chloro-4-thiochromanyl-O,O-diethyl dithiophosphate, sulfanyl-diethoxy-sulfanylidene-phosphorane, S-(6-Chloro-3,4-dihydro-2H-1-benzothiopyran-4-yl) O,O-diethyl phosphorodithioate
| Molecular Formula | C13H18ClO2PS3 |
|---|---|
| Molecular Weight | 367.99 g/mol |
| LogP | 5.2 |
| Topological Polar Surface Area | 101.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 367.9895 |
| Heavy Atoms | 20 |
| Complexity | 349.0 |
Chemical Identifiers
| CAS Number | 5367-88-4 |
|---|---|
| SMILES | CCOP(=S)(OCC)SC1CCSC2=C1C=C(C=C2)Cl |
| InChIKey | QNZZKGBRJAVCIQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Dithicrofos (CAS 5367-88-4), with molecular formula C13H18ClO2PS3 and molecular weight 367.99 g/mol. IUPAC: (6-chloro-3,4-dihydro-2H-thiochromen-4-yl)sulfanyl-diethoxy-sulfanylidene-λ5-phosphane.
Chemical Property Profile of Dithicrofos
Property Insights of Dithicrofos
The XLogP value of 5.2 indicates that Dithicrofos is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Dithicrofos. Following Lipinski's Rule of Five, Dithicrofos has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Dithicrofos?
The CAS number of Dithicrofos is 5367-88-4.
What is the molecular formula of Dithicrofos?
The molecular formula of Dithicrofos is C13H18ClO2PS3.
What is the molecular weight of Dithicrofos?
The molecular weight of Dithicrofos is 367.99 g/mol.
Where can I buy Dithicrofos?
You can request a quote for Dithicrofos directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dithicrofos?
Yes, KEHONG BIO provides custom synthesis services for Dithicrofos and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.