p-Benzoquinone, 2-hydroxy-5-(phenylthio)-
TL;DR: p-Benzoquinone, 2-hydroxy-5-(phenylthio)- (CAS 19346-86-2) is a chemical compound with molecular formula C12H8O3S and molecular weight 232.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hydroxy-5-phenylsulfanylcyclohexa-2,5-diene-1,4-dione
Also Known As: p-Benzoquinone, 2-hydroxy-5-(phenylthio)-, 2-Hydroxy-5-(phenylthio)-p-benzoquinone, 2-Phenylthio-5-hydroxy-p-benzochinon, 2-hydroxy-5-phenylsulfanylcyclohexa-2,5-diene-1,4-dione, 2-Hydroxy-5-(phenylsulfanyl)benzo-1,4-quinone #
| Molecular Formula | C12H8O3S |
|---|---|
| Molecular Weight | 232.02 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 79.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 232.01941 |
| Heavy Atoms | 16 |
| Complexity | 376.0 |
Chemical Identifiers
| CAS Number | 19346-86-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)SC2=CC(=O)C(=CC2=O)O |
| InChIKey | BVGCXZVLEWNGCF-UHFFFAOYSA-N |
Product Overview
p-Benzoquinone, 2-hydroxy-5-(phenylthio)- (CAS 19346-86-2), with molecular formula C12H8O3S and molecular weight 232.02 g/mol. IUPAC: 2-hydroxy-5-phenylsulfanylcyclohexa-2,5-diene-1,4-dione.
Chemical Property Profile of p-Benzoquinone, 2-hydroxy-5-(phenylthio)-
Property Insights of p-Benzoquinone, 2-hydroxy-5-(phenylthio)-
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for p-Benzoquinone, 2-hydroxy-5-(phenylthio)-. The TPSA of 79.7 Ų falls within the moderate polarity range, balancing permeability and solubility for p-Benzoquinone, 2-hydroxy-5-(phenylthio)-. Following Lipinski's Rule of Five, p-Benzoquinone, 2-hydroxy-5-(phenylthio)- has 1 hydrogen bond donor(s) and 4 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-hydroxy-5-(phenylthio)-?
The CAS number of p-Benzoquinone, 2-hydroxy-5-(phenylthio)- is 19346-86-2.
What is the molecular formula of p-Benzoquinone, 2-hydroxy-5-(phenylthio)-?
The molecular formula of p-Benzoquinone, 2-hydroxy-5-(phenylthio)- is C12H8O3S.
What is the molecular weight of p-Benzoquinone, 2-hydroxy-5-(phenylthio)-?
The molecular weight of p-Benzoquinone, 2-hydroxy-5-(phenylthio)- is 232.02 g/mol.
Where can I buy p-Benzoquinone, 2-hydroxy-5-(phenylthio)-?
You can request a quote for p-Benzoquinone, 2-hydroxy-5-(phenylthio)- 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-hydroxy-5-(phenylthio)-?
Yes, KEHONG BIO provides custom synthesis services for p-Benzoquinone, 2-hydroxy-5-(phenylthio)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.