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Benzene, 1-methyl-4-[[(methylthio)methyl]thio]-
TL;DR: Benzene, 1-methyl-4-[[(methylthio)methyl]thio]- (CAS 62926-93-6) is a chemical compound with molecular formula C9H12S2 and molecular weight 184.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-4-(methylsulfanylmethylsulfanyl)benzene
Also Known As: Methylthiomethyl-p-tolylsulfid, methyl((p-tolylthio)methyl)sulfane, (METHYLTHIO)(P-TOLYLTHIO)METHANE, 1-methyl-4-(methylsulfanylmethylsulfanyl)benzene, Benzene, 1-methyl-4-[[(methylthio)methyl]thio]-
| Molecular Formula | C9H12S2 |
|---|---|
| Molecular Weight | 184.04 g/mol |
| LogP | 3.40762 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 184.03804 |
| Heavy Atoms | 11 |
| Complexity | 203.30765 |
Chemical Identifiers
| CAS Number | 62926-93-6 |
|---|---|
| SMILES | CC1=CC=C(C=C1)SCSC |
Product Overview
Benzene, 1-methyl-4-[[(methylthio)methyl]thio]- (CAS 62926-93-6), with molecular formula C9H12S2 and molecular weight 184.04 g/mol. IUPAC: 1-methyl-4-(methylsulfanylmethylsulfanyl)benzene.
Chemical Property Profile of Benzene, 1-methyl-4-[[(methylthio)methyl]thio]-
Property Insights of Benzene, 1-methyl-4-[[(methylthio)methyl]thio]-
The XLogP value of 3.40762 indicates that Benzene, 1-methyl-4-[[(methylthio)methyl]thio]- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Benzene, 1-methyl-4-[[(methylthio)methyl]thio]- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzene, 1-methyl-4-[[(methylthio)methyl]thio]- 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 Benzene, 1-methyl-4-[[(methylthio)methyl]thio]-?
The CAS number of Benzene, 1-methyl-4-[[(methylthio)methyl]thio]- is 62926-93-6.
What is the molecular formula of Benzene, 1-methyl-4-[[(methylthio)methyl]thio]-?
The molecular formula of Benzene, 1-methyl-4-[[(methylthio)methyl]thio]- is C9H12S2.
What is the molecular weight of Benzene, 1-methyl-4-[[(methylthio)methyl]thio]-?
The molecular weight of Benzene, 1-methyl-4-[[(methylthio)methyl]thio]- is 184.04 g/mol.
Where can I buy Benzene, 1-methyl-4-[[(methylthio)methyl]thio]-?
You can request a quote for Benzene, 1-methyl-4-[[(methylthio)methyl]thio]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzene, 1-methyl-4-[[(methylthio)methyl]thio]-?
Yes, KEHONG BIO provides custom synthesis services for Benzene, 1-methyl-4-[[(methylthio)methyl]thio]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.