Phenol, p-(2-methyl-1,3-dithiolan-2-yl)-
TL;DR: Phenol, p-(2-methyl-1,3-dithiolan-2-yl)- (CAS 25189-55-3) is a chemical compound with molecular formula C10H12OS2 and molecular weight 212.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2-methyl-1,3-dithiolan-2-yl)phenol
Also Known As: 4-(2-methyl-1,3-dithiolan-2-yl)phenol, 4-Hexyn-3-ol, methyldithiolanylbenzenol, 4-(2-Methyl-1,3-dithiolan-2-yl)benzenol, p-(2-Methyl-1,3-dithiolan-2-yl)phenol
| Molecular Formula | C10H12OS2 |
|---|---|
| Molecular Weight | 212.03 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 70.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 212.03296 |
| Heavy Atoms | 13 |
| Complexity | 170.0 |
Chemical Identifiers
| CAS Number | 25189-55-3 |
|---|---|
| SMILES | CC1(SCCS1)C2=CC=C(C=C2)O |
| InChIKey | QTPANKHZSIPRCL-UHFFFAOYSA-N |
Product Overview
Phenol, p-(2-methyl-1,3-dithiolan-2-yl)- (CAS 25189-55-3), with molecular formula C10H12OS2 and molecular weight 212.03 g/mol. IUPAC: 4-(2-methyl-1,3-dithiolan-2-yl)phenol.
Chemical Property Profile of Phenol, p-(2-methyl-1,3-dithiolan-2-yl)-
Property Insights of Phenol, p-(2-methyl-1,3-dithiolan-2-yl)-
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phenol, p-(2-methyl-1,3-dithiolan-2-yl)-. The TPSA of 70.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Phenol, p-(2-methyl-1,3-dithiolan-2-yl)-. Following Lipinski's Rule of Five, Phenol, p-(2-methyl-1,3-dithiolan-2-yl)- has 1 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 Phenol, p-(2-methyl-1,3-dithiolan-2-yl)-?
The CAS number of Phenol, p-(2-methyl-1,3-dithiolan-2-yl)- is 25189-55-3.
What is the molecular formula of Phenol, p-(2-methyl-1,3-dithiolan-2-yl)-?
The molecular formula of Phenol, p-(2-methyl-1,3-dithiolan-2-yl)- is C10H12OS2.
What is the molecular weight of Phenol, p-(2-methyl-1,3-dithiolan-2-yl)-?
The molecular weight of Phenol, p-(2-methyl-1,3-dithiolan-2-yl)- is 212.03 g/mol.
Where can I buy Phenol, p-(2-methyl-1,3-dithiolan-2-yl)-?
You can request a quote for Phenol, p-(2-methyl-1,3-dithiolan-2-yl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenol, p-(2-methyl-1,3-dithiolan-2-yl)-?
Yes, KEHONG BIO provides custom synthesis services for Phenol, p-(2-methyl-1,3-dithiolan-2-yl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.