Diphenylphosphinothioyl isothiocyanate
TL;DR: Diphenylphosphinothioyl isothiocyanate (CAS 16523-56-1) is a chemical compound with molecular formula C13H10NPS2 and molecular weight 274.99924 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
isothiocyanato-diphenyl-sulfanylidene-λ5-phosphane
Also Known As: Diphenylphosphinothioyl isothiocyanate, Diphenylthiophosphinyl thiocyanate, Diphenylphosphinothioic isothiocyanate, Phosphinothioic isothiocyanate, diphenyl-, Diphenylphosphinylthioyl isothiocyanate
Technical Specifications
| Molecular Formula | C13H10NPS2 |
| Molecular Weight | 274.99924 g/mol |
| XLogP | 6.0 |
| Topological Polar Surface Area (TPSA) | 76.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 274.99924 Da |
| Heavy Atoms | 17 |
| Complexity | 315.0 |
| SMILES | C1=CC=C(C=C1)P(=S)(C2=CC=CC=C2)N=C=S |
| InChIKey | BURBFXMRJHUQTI-UHFFFAOYSA-N |
Chemical Property Profile of Diphenylphosphinothioyl isothiocyanate
Property Insights of Diphenylphosphinothioyl isothiocyanate
The XLogP value of 6.0 indicates that Diphenylphosphinothioyl isothiocyanate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Diphenylphosphinothioyl isothiocyanate. Following Lipinski's Rule of Five, Diphenylphosphinothioyl isothiocyanate has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Diphenylphosphinothioyl isothiocyanate?
The CAS number of Diphenylphosphinothioyl isothiocyanate is 16523-56-1.
What is the molecular formula of Diphenylphosphinothioyl isothiocyanate?
The molecular formula of Diphenylphosphinothioyl isothiocyanate is C13H10NPS2.
What is the molecular weight of Diphenylphosphinothioyl isothiocyanate?
The molecular weight of Diphenylphosphinothioyl isothiocyanate is 274.99924 g/mol.
Where can I buy Diphenylphosphinothioyl isothiocyanate?
You can request a quote for Diphenylphosphinothioyl isothiocyanate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Diphenylphosphinothioyl isothiocyanate?
Yes, CoreyChem provides custom synthesis services for Diphenylphosphinothioyl isothiocyanate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.