Methiochlor
TL;DR: Methiochlor (CAS 19679-38-0) is a chemical compound with molecular formula C16H15Cl3S2 and molecular weight 375.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methylsulfanyl-4-[2,2,2-trichloro-1-(4-methylsulfanylphenyl)ethyl]benzene
Also Known As: Methiochlor, AI3-16810, Ethane, 2,2-bis(p-(methylthio)phenyl)-1,1,1-trichloro-, 2,2-Bis(p-(methylthio)phenyl)-1,1,1-trichloroethane, 4-06-00-06693 (Beilstein Handbook Reference)
| Molecular Formula | C16H15Cl3S2 |
|---|---|
| Molecular Weight | 375.97 g/mol |
| LogP | 6.7 |
| Topological Polar Surface Area | 50.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 375.96808 |
| Heavy Atoms | 21 |
| Complexity | 279.0 |
Chemical Identifiers
| CAS Number | 19679-38-0 |
|---|---|
| SMILES | CSC1=CC=C(C=C1)C(C2=CC=C(C=C2)SC)C(Cl)(Cl)Cl |
| InChIKey | LBWJWHHOEQICIL-UHFFFAOYSA-N |
Product Overview
Methiochlor (CAS 19679-38-0), with molecular formula C16H15Cl3S2 and molecular weight 375.97 g/mol. IUPAC: 1-methylsulfanyl-4-[2,2,2-trichloro-1-(4-methylsulfanylphenyl)ethyl]benzene.
Chemical Property Profile of Methiochlor
Property Insights of Methiochlor
The XLogP value of 6.7 indicates that Methiochlor is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.6 Ų, Methiochlor exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methiochlor has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Methiochlor?
The CAS number of Methiochlor is 19679-38-0.
What is the molecular formula of Methiochlor?
The molecular formula of Methiochlor is C16H15Cl3S2.
What is the molecular weight of Methiochlor?
The molecular weight of Methiochlor is 375.97 g/mol.
Where can I buy Methiochlor?
You can request a quote for Methiochlor directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methiochlor?
Yes, KEHONG BIO provides custom synthesis services for Methiochlor and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.