N-(Bis((trichloromethyl)dithio)methylene)-4-methylaniline
TL;DR: N-(Bis((trichloromethyl)dithio)methylene)-4-methylaniline (CAS 65331-42-2) is a chemical compound with molecular formula C10H7Cl6NS4 and molecular weight 478.76 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-methylphenyl)-1,1-bis(trichloromethyldisulfanyl)methanimine
Also Known As: N-(Bis((trichloromethyl)dithio)methylene)-4-methylaniline, N-(4-methylphenyl)-1,1-bis(trichloromethyldisulfanyl)methanimine, N-(Bis((trichloromethyl)dithio)methylene)-N-(4-methylphenyl)amine, N-(4-methylphenyl)-1,1-bis[(trichloromethyl)disulfanyl]methanimine, N-(p-tolyl)-1,1-bis(trichloromethyldisulfanyl)methanimine
| Molecular Formula | C10H7Cl6NS4 |
|---|---|
| Molecular Weight | 478.76 g/mol |
| LogP | 7.8 |
| Topological Polar Surface Area | 114.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 478.75925 |
| Heavy Atoms | 21 |
| Complexity | 328.0 |
Chemical Identifiers
| CAS Number | 65331-42-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N=C(SSC(Cl)(Cl)Cl)SSC(Cl)(Cl)Cl |
| InChIKey | RLLBLLGJNVXJGL-UHFFFAOYSA-N |
Product Overview
N-(Bis((trichloromethyl)dithio)methylene)-4-methylaniline (CAS 65331-42-2), with molecular formula C10H7Cl6NS4 and molecular weight 478.76 g/mol. IUPAC: N-(4-methylphenyl)-1,1-bis(trichloromethyldisulfanyl)methanimine.
Chemical Property Profile of N-(Bis((trichloromethyl)dithio)methylene)-4-methylaniline
Property Insights of N-(Bis((trichloromethyl)dithio)methylene)-4-methylaniline
The XLogP value of 7.8 indicates that N-(Bis((trichloromethyl)dithio)methylene)-4-methylaniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 114.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(Bis((trichloromethyl)dithio)methylene)-4-methylaniline. Following Lipinski's Rule of Five, N-(Bis((trichloromethyl)dithio)methylene)-4-methylaniline 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 N-(Bis((trichloromethyl)dithio)methylene)-4-methylaniline?
The CAS number of N-(Bis((trichloromethyl)dithio)methylene)-4-methylaniline is 65331-42-2.
What is the molecular formula of N-(Bis((trichloromethyl)dithio)methylene)-4-methylaniline?
The molecular formula of N-(Bis((trichloromethyl)dithio)methylene)-4-methylaniline is C10H7Cl6NS4.
What is the molecular weight of N-(Bis((trichloromethyl)dithio)methylene)-4-methylaniline?
The molecular weight of N-(Bis((trichloromethyl)dithio)methylene)-4-methylaniline is 478.76 g/mol.
Where can I buy N-(Bis((trichloromethyl)dithio)methylene)-4-methylaniline?
You can request a quote for N-(Bis((trichloromethyl)dithio)methylene)-4-methylaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(Bis((trichloromethyl)dithio)methylene)-4-methylaniline?
Yes, KEHONG BIO provides custom synthesis services for N-(Bis((trichloromethyl)dithio)methylene)-4-methylaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.