Trichloro(cyanodisulfanyl)methane
TL;DR: Trichloro(cyanodisulfanyl)methane (CAS 90993-60-5) is a chemical compound with molecular formula C2Cl3NS2 and molecular weight 206.85 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trichloromethylsulfanyl thiocyanate
Also Known As: trichloro(cyanodisulfanyl)methane, trichloromethylsulfanyl thiocyanate
| Molecular Formula | C2Cl3NS2 |
|---|---|
| Molecular Weight | 206.85 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 74.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 206.85378 |
| Heavy Atoms | 8 |
| Complexity | 110.0 |
Chemical Identifiers
| CAS Number | 90993-60-5 |
|---|---|
| SMILES | C(#N)SSC(Cl)(Cl)Cl |
| InChIKey | BJKFXKPCXGTVAW-UHFFFAOYSA-N |
Product Overview
Trichloro(cyanodisulfanyl)methane (CAS 90993-60-5), with molecular formula C2Cl3NS2 and molecular weight 206.85 g/mol. IUPAC: trichloromethylsulfanyl thiocyanate.
Chemical Property Profile of Trichloro(cyanodisulfanyl)methane
Property Insights of Trichloro(cyanodisulfanyl)methane
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Trichloro(cyanodisulfanyl)methane. The TPSA of 74.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Trichloro(cyanodisulfanyl)methane. Following Lipinski's Rule of Five, Trichloro(cyanodisulfanyl)methane has 0 hydrogen bond donor(s) and 3 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 Trichloro(cyanodisulfanyl)methane?
The CAS number of Trichloro(cyanodisulfanyl)methane is 90993-60-5.
What is the molecular formula of Trichloro(cyanodisulfanyl)methane?
The molecular formula of Trichloro(cyanodisulfanyl)methane is C2Cl3NS2.
What is the molecular weight of Trichloro(cyanodisulfanyl)methane?
The molecular weight of Trichloro(cyanodisulfanyl)methane is 206.85 g/mol.
Where can I buy Trichloro(cyanodisulfanyl)methane?
You can request a quote for Trichloro(cyanodisulfanyl)methane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Trichloro(cyanodisulfanyl)methane?
Yes, KEHONG BIO provides custom synthesis services for Trichloro(cyanodisulfanyl)methane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.