(2,2-Diethoxyethyl)(p-tolyl)sulfane
TL;DR: (2,2-Diethoxyethyl)(p-tolyl)sulfane (CAS 51830-50-3) is a chemical compound with molecular formula C13H20O2S and molecular weight 240.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,2-diethoxyethylsulfanyl)-4-methylbenzene
Also Known As: (2,2-Diethoxyethyl)(p-tolyl)sulfane, p-(Tolylthio)acetaldehyde diethyl acetal, P- ACETALDEHYDEDIETHYLACETAL, 7266AB, 1-(2,2-diethoxyethylsulfanyl)-4-methylbenzene
| Molecular Formula | C13H20O2S |
|---|---|
| Molecular Weight | 240.12 g/mol |
| LogP | 3.48622 |
| Topological Polar Surface Area | 18.46 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 240.11841 |
| Heavy Atoms | 16 |
| Complexity | 278.48898 |
Chemical Identifiers
| CAS Number | 51830-50-3 |
|---|---|
| SMILES | CCOC(CSC1=CC=C(C=C1)C)OCC |
Product Overview
(2,2-Diethoxyethyl)(p-tolyl)sulfane (CAS 51830-50-3), with molecular formula C13H20O2S and molecular weight 240.12 g/mol. IUPAC: 1-(2,2-diethoxyethylsulfanyl)-4-methylbenzene.
Chemical Property Profile of (2,2-Diethoxyethyl)(p-tolyl)sulfane
Property Insights of (2,2-Diethoxyethyl)(p-tolyl)sulfane
The XLogP value of 3.48622 indicates that (2,2-Diethoxyethyl)(p-tolyl)sulfane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.46 Ų, (2,2-Diethoxyethyl)(p-tolyl)sulfane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2,2-Diethoxyethyl)(p-tolyl)sulfane 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 (2,2-Diethoxyethyl)(p-tolyl)sulfane?
The CAS number of (2,2-Diethoxyethyl)(p-tolyl)sulfane is 51830-50-3.
What is the molecular formula of (2,2-Diethoxyethyl)(p-tolyl)sulfane?
The molecular formula of (2,2-Diethoxyethyl)(p-tolyl)sulfane is C13H20O2S.
What is the molecular weight of (2,2-Diethoxyethyl)(p-tolyl)sulfane?
The molecular weight of (2,2-Diethoxyethyl)(p-tolyl)sulfane is 240.12 g/mol.
Where can I buy (2,2-Diethoxyethyl)(p-tolyl)sulfane?
You can request a quote for (2,2-Diethoxyethyl)(p-tolyl)sulfane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2,2-Diethoxyethyl)(p-tolyl)sulfane?
Yes, KEHONG BIO provides custom synthesis services for (2,2-Diethoxyethyl)(p-tolyl)sulfane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.