p-Benzoquinone, 2-(methylthio)-
TL;DR: p-Benzoquinone, 2-(methylthio)- (CAS 18232-06-9) is a chemical compound with molecular formula C7H6O2S and molecular weight 154.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methylsulfanylcyclohexa-2,5-diene-1,4-dione
Also Known As: p-Benzoquinone, 2-(methylthio)-, 2-methylthio-1,4-benzoquinone, 2-(Methylthio)-1,4-benzoquinone, 2-methylsulfanylcyclohexa-2,5-diene-1,4-dione, 2-(Methylsulfanyl)benzo-1,4-quinone #
| Molecular Formula | C7H6O2S |
|---|---|
| Molecular Weight | 154.01 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 59.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 154.00885 |
| Heavy Atoms | 10 |
| Complexity | 238.0 |
Chemical Identifiers
| CAS Number | 18232-06-9 |
|---|---|
| SMILES | CSC1=CC(=O)C=CC1=O |
| InChIKey | WITSQZWTUMQIBS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
p-Benzoquinone, 2-(methylthio)- (CAS 18232-06-9), with molecular formula C7H6O2S and molecular weight 154.01 g/mol. IUPAC: 2-methylsulfanylcyclohexa-2,5-diene-1,4-dione.
Chemical Property Profile of p-Benzoquinone, 2-(methylthio)-
Property Insights of p-Benzoquinone, 2-(methylthio)-
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for p-Benzoquinone, 2-(methylthio)-. With a topological polar surface area (TPSA) of 59.4 Ų, p-Benzoquinone, 2-(methylthio)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, p-Benzoquinone, 2-(methylthio)- 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 p-Benzoquinone, 2-(methylthio)-?
The CAS number of p-Benzoquinone, 2-(methylthio)- is 18232-06-9.
What is the molecular formula of p-Benzoquinone, 2-(methylthio)-?
The molecular formula of p-Benzoquinone, 2-(methylthio)- is C7H6O2S.
What is the molecular weight of p-Benzoquinone, 2-(methylthio)-?
The molecular weight of p-Benzoquinone, 2-(methylthio)- is 154.01 g/mol.
Where can I buy p-Benzoquinone, 2-(methylthio)-?
You can request a quote for p-Benzoquinone, 2-(methylthio)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for p-Benzoquinone, 2-(methylthio)-?
Yes, KEHONG BIO provides custom synthesis services for p-Benzoquinone, 2-(methylthio)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.