![1-Chloro-4-{[(trichloromethyl)disulfanyl]methyl}benzene structure](/static/products/941/94137-99-2.png)
1-Chloro-4-{[(trichloromethyl)disulfanyl]methyl}benzene
TL;DR: 1-Chloro-4-{[(trichloromethyl)disulfanyl]methyl}benzene (CAS 94137-99-2) is a chemical compound with molecular formula C8H6Cl4S2 and molecular weight 305.87 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-chloro-4-[(trichloromethyldisulfanyl)methyl]benzene
Also Known As: 1-chloro-4-[(trichloromethyldisulfanyl)methyl]benzene, 1-Chloro-4-{[(trichloromethyl)disulfanyl]methyl}benzene, Disulfide,(4-chlorophenyl)methyl trichloromethyl (9ci)
| Molecular Formula | C8H6Cl4S2 |
|---|---|
| Molecular Weight | 305.87 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 50.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 305.86652 |
| Heavy Atoms | 14 |
| Complexity | 163.0 |
Chemical Identifiers
| CAS Number | 94137-99-2 |
|---|---|
| SMILES | C1=CC(=CC=C1CSSC(Cl)(Cl)Cl)Cl |
| InChIKey | ARSDVWRPZXGZKR-UHFFFAOYSA-N |
Product Overview
1-Chloro-4-{[(trichloromethyl)disulfanyl]methyl}benzene (CAS 94137-99-2), with molecular formula C8H6Cl4S2 and molecular weight 305.87 g/mol. IUPAC: 1-chloro-4-[(trichloromethyldisulfanyl)methyl]benzene.
Chemical Property Profile of 1-Chloro-4-{[(trichloromethyl)disulfanyl]methyl}benzene
Property Insights of 1-Chloro-4-{[(trichloromethyl)disulfanyl]methyl}benzene
The XLogP value of 5.0 indicates that 1-Chloro-4-{[(trichloromethyl)disulfanyl]methyl}benzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.6 Ų, 1-Chloro-4-{[(trichloromethyl)disulfanyl]methyl}benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Chloro-4-{[(trichloromethyl)disulfanyl]methyl}benzene has 0 hydrogen bond donor(s) and 2 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 1-Chloro-4-{[(trichloromethyl)disulfanyl]methyl}benzene?
The CAS number of 1-Chloro-4-{[(trichloromethyl)disulfanyl]methyl}benzene is 94137-99-2.
What is the molecular formula of 1-Chloro-4-{[(trichloromethyl)disulfanyl]methyl}benzene?
The molecular formula of 1-Chloro-4-{[(trichloromethyl)disulfanyl]methyl}benzene is C8H6Cl4S2.
What is the molecular weight of 1-Chloro-4-{[(trichloromethyl)disulfanyl]methyl}benzene?
The molecular weight of 1-Chloro-4-{[(trichloromethyl)disulfanyl]methyl}benzene is 305.87 g/mol.
Where can I buy 1-Chloro-4-{[(trichloromethyl)disulfanyl]methyl}benzene?
You can request a quote for 1-Chloro-4-{[(trichloromethyl)disulfanyl]methyl}benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Chloro-4-{[(trichloromethyl)disulfanyl]methyl}benzene?
Yes, KEHONG BIO provides custom synthesis services for 1-Chloro-4-{[(trichloromethyl)disulfanyl]methyl}benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.