![3-[(Methanesulfinyl)methyl]cyclohexa-3,5-diene-1,2-diol structure](/static/products/7224/7224-76-2.webp)
3-[(Methanesulfinyl)methyl]cyclohexa-3,5-diene-1,2-diol
TL;DR: 3-[(Methanesulfinyl)methyl]cyclohexa-3,5-diene-1,2-diol (CAS 7224-76-2) is a chemical compound with molecular formula C8H12O3S and molecular weight 188.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(methylsulfinylmethyl)cyclohexa-3,5-diene-1,2-diol
Also Known As: 3-[(Methanesulfinyl)methyl]cyclohexa-3,5-diene-1,2-diol, 2-(methylsulfinylmethyl)cyclohexa-2,4-diene-1,6-diol, 3-(methylsulfinylmethyl)cyclohexa-3,5-diene-1,2-diol
| Molecular Formula | C8H12O3S |
|---|---|
| Molecular Weight | 188.05 g/mol |
| LogP | -0.4171 |
| Topological Polar Surface Area | 57.53 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 188.05072 |
| Heavy Atoms | 12 |
| Complexity | 244.68753 |
Chemical Identifiers
| CAS Number | 7224-76-2 |
|---|---|
| SMILES | CS(=O)CC1=CC=CC(C1O)O |
Product Overview
3-[(Methanesulfinyl)methyl]cyclohexa-3,5-diene-1,2-diol (CAS 7224-76-2), with molecular formula C8H12O3S and molecular weight 188.05 g/mol. IUPAC: 3-(methylsulfinylmethyl)cyclohexa-3,5-diene-1,2-diol.
Chemical Property Profile of 3-[(Methanesulfinyl)methyl]cyclohexa-3,5-diene-1,2-diol
Property Insights of 3-[(Methanesulfinyl)methyl]cyclohexa-3,5-diene-1,2-diol
The XLogP value of -0.4171 indicates that 3-[(Methanesulfinyl)methyl]cyclohexa-3,5-diene-1,2-diol is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 57.53 Ų, 3-[(Methanesulfinyl)methyl]cyclohexa-3,5-diene-1,2-diol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[(Methanesulfinyl)methyl]cyclohexa-3,5-diene-1,2-diol has 2 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 3-[(Methanesulfinyl)methyl]cyclohexa-3,5-diene-1,2-diol?
The CAS number of 3-[(Methanesulfinyl)methyl]cyclohexa-3,5-diene-1,2-diol is 7224-76-2.
What is the molecular formula of 3-[(Methanesulfinyl)methyl]cyclohexa-3,5-diene-1,2-diol?
The molecular formula of 3-[(Methanesulfinyl)methyl]cyclohexa-3,5-diene-1,2-diol is C8H12O3S.
What is the molecular weight of 3-[(Methanesulfinyl)methyl]cyclohexa-3,5-diene-1,2-diol?
The molecular weight of 3-[(Methanesulfinyl)methyl]cyclohexa-3,5-diene-1,2-diol is 188.05 g/mol.
Where can I buy 3-[(Methanesulfinyl)methyl]cyclohexa-3,5-diene-1,2-diol?
You can request a quote for 3-[(Methanesulfinyl)methyl]cyclohexa-3,5-diene-1,2-diol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[(Methanesulfinyl)methyl]cyclohexa-3,5-diene-1,2-diol?
Yes, KEHONG BIO provides custom synthesis services for 3-[(Methanesulfinyl)methyl]cyclohexa-3,5-diene-1,2-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.