(2-Fluorophenyl) methyl cyanocarbonimidodithioate
TL;DR: (2-Fluorophenyl) methyl cyanocarbonimidodithioate (CAS 152382-00-8) is a chemical compound with molecular formula C9H7FN2S2 and molecular weight 226.00346 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(2-fluorophenyl)sulfanyl-methylsulfanylmethylidene]cyanamide
Also Known As: (2-Fluorophenyl) methyl cyanocarbonimidodithioate, [(2-fluorophenyl)sulfanyl-methylsulfanylmethylidene]cyanamide, 2-Fluorophenyl methyl cyanocarbonodithioimidate, 2-fluorophenyl methyl cyanodithioimidocarbonate, AI-067/31570030
Technical Specifications
| Molecular Formula | C9H7FN2S2 |
| Molecular Weight | 226.00346 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 86.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 226.00346 Da |
| Heavy Atoms | 14 |
| Complexity | 259.0 |
| SMILES | CSC(=NC#N)SC1=CC=CC=C1F |
| InChIKey | UZDCJCTYNVROHE-UHFFFAOYSA-N |
Chemical Property Profile of (2-Fluorophenyl) methyl cyanocarbonimidodithioate
Property Insights of (2-Fluorophenyl) methyl cyanocarbonimidodithioate
The XLogP value of 3.6 indicates that (2-Fluorophenyl) methyl cyanocarbonimidodithioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.8 Ų falls within the moderate polarity range, balancing permeability and solubility for (2-Fluorophenyl) methyl cyanocarbonimidodithioate. Following Lipinski's Rule of Five, (2-Fluorophenyl) methyl cyanocarbonimidodithioate has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of (2-Fluorophenyl) methyl cyanocarbonimidodithioate?
The CAS number of (2-Fluorophenyl) methyl cyanocarbonimidodithioate is 152382-00-8.
What is the molecular formula of (2-Fluorophenyl) methyl cyanocarbonimidodithioate?
The molecular formula of (2-Fluorophenyl) methyl cyanocarbonimidodithioate is C9H7FN2S2.
What is the molecular weight of (2-Fluorophenyl) methyl cyanocarbonimidodithioate?
The molecular weight of (2-Fluorophenyl) methyl cyanocarbonimidodithioate is 226.00346 g/mol.
Where can I buy (2-Fluorophenyl) methyl cyanocarbonimidodithioate?
You can request a quote for (2-Fluorophenyl) methyl cyanocarbonimidodithioate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (2-Fluorophenyl) methyl cyanocarbonimidodithioate?
Yes, CoreyChem provides custom synthesis services for (2-Fluorophenyl) methyl cyanocarbonimidodithioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.