Phosphorodithioic acid, S-(cyclohexylethynyl) O,O-diethyl ester
TL;DR: Phosphorodithioic acid, S-(cyclohexylethynyl) O,O-diethyl ester (CAS 111234-53-8) is a chemical compound with molecular formula C12H21O2PS2 and molecular weight 292.07205 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-cyclohexylethynylsulfanyl-diethoxy-sulfanylidene-λ5-phosphane
Also Known As: Phosphorodithioic acid, S-(cyclohexylethynyl) O,O-diethyl ester, 2-cyclohexylethynylsulfanyl-diethoxy-sulfanylidene-, S-Cyclohexylethynyl O,O-diethyl phosphorodithioate, 2-cyclohexylethynylsulfanyl-diethoxy-sulfanylidene-phosphorane
Technical Specifications
| Molecular Formula | C12H21O2PS2 |
| Molecular Weight | 292.07205 g/mol |
| XLogP | 5.4 |
| Topological Polar Surface Area (TPSA) | 75.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 292.07205 Da |
| Heavy Atoms | 17 |
| Complexity | 316.0 |
| SMILES | CCOP(=S)(OCC)SC#CC1CCCCC1 |
| InChIKey | YKRRBCUWOGJMOD-UHFFFAOYSA-N |
Chemical Property Profile of Phosphorodithioic acid, S-(cyclohexylethynyl) O,O-diethyl ester
Property Insights of Phosphorodithioic acid, S-(cyclohexylethynyl) O,O-diethyl ester
The XLogP value of 5.4 indicates that Phosphorodithioic acid, S-(cyclohexylethynyl) O,O-diethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Phosphorodithioic acid, S-(cyclohexylethynyl) O,O-diethyl ester. Following Lipinski's Rule of Five, Phosphorodithioic acid, S-(cyclohexylethynyl) O,O-diethyl ester has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Phosphorodithioic acid, S-(cyclohexylethynyl) O,O-diethyl ester?
The CAS number of Phosphorodithioic acid, S-(cyclohexylethynyl) O,O-diethyl ester is 111234-53-8.
What is the molecular formula of Phosphorodithioic acid, S-(cyclohexylethynyl) O,O-diethyl ester?
The molecular formula of Phosphorodithioic acid, S-(cyclohexylethynyl) O,O-diethyl ester is C12H21O2PS2.
What is the molecular weight of Phosphorodithioic acid, S-(cyclohexylethynyl) O,O-diethyl ester?
The molecular weight of Phosphorodithioic acid, S-(cyclohexylethynyl) O,O-diethyl ester is 292.07205 g/mol.
Where can I buy Phosphorodithioic acid, S-(cyclohexylethynyl) O,O-diethyl ester?
You can request a quote for Phosphorodithioic acid, S-(cyclohexylethynyl) O,O-diethyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Phosphorodithioic acid, S-(cyclohexylethynyl) O,O-diethyl ester?
Yes, CoreyChem provides custom synthesis services for Phosphorodithioic acid, S-(cyclohexylethynyl) O,O-diethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.