![2-Methyl-2-[(4-methylphenyl)sulfanyl]propanal structure](/static/products/1104/110452-12-5.webp)
2-Methyl-2-[(4-methylphenyl)sulfanyl]propanal
TL;DR: 2-Methyl-2-[(4-methylphenyl)sulfanyl]propanal (CAS 110452-12-5) is a chemical compound with molecular formula C11H14OS and molecular weight 194.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-2-(4-methylphenyl)sulfanylpropanal
Also Known As: 2-methyl-2-[(4-methylphenyl)sulfanyl]propanal, 2-methyl-2-(4-methylphenyl)sulfanylpropanal, 2-Methyl-2-(p-tolylthio)propanal, Propanal, 2-methyl-2-[(4-methylphenyl)thio]-, 2-methyl-2-(p-tolylsulfanyl)propanal
| Molecular Formula | C11H14OS |
|---|---|
| Molecular Weight | 194.08 g/mol |
| LogP | 3.06462 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 194.07654 |
| Heavy Atoms | 13 |
| Complexity | 287.46353 |
Chemical Identifiers
| CAS Number | 110452-12-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)SC(C)(C)C=O |
Product Overview
2-Methyl-2-[(4-methylphenyl)sulfanyl]propanal (CAS 110452-12-5), with molecular formula C11H14OS and molecular weight 194.08 g/mol. IUPAC: 2-methyl-2-(4-methylphenyl)sulfanylpropanal.
Chemical Property Profile of 2-Methyl-2-[(4-methylphenyl)sulfanyl]propanal
Property Insights of 2-Methyl-2-[(4-methylphenyl)sulfanyl]propanal
The XLogP value of 3.06462 indicates that 2-Methyl-2-[(4-methylphenyl)sulfanyl]propanal is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.07 Ų, 2-Methyl-2-[(4-methylphenyl)sulfanyl]propanal exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methyl-2-[(4-methylphenyl)sulfanyl]propanal has 0 hydrogen bond donor(s) and 2 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-Methyl-2-[(4-methylphenyl)sulfanyl]propanal?
The CAS number of 2-Methyl-2-[(4-methylphenyl)sulfanyl]propanal is 110452-12-5.
What is the molecular formula of 2-Methyl-2-[(4-methylphenyl)sulfanyl]propanal?
The molecular formula of 2-Methyl-2-[(4-methylphenyl)sulfanyl]propanal is C11H14OS.
What is the molecular weight of 2-Methyl-2-[(4-methylphenyl)sulfanyl]propanal?
The molecular weight of 2-Methyl-2-[(4-methylphenyl)sulfanyl]propanal is 194.08 g/mol.
Where can I buy 2-Methyl-2-[(4-methylphenyl)sulfanyl]propanal?
You can request a quote for 2-Methyl-2-[(4-methylphenyl)sulfanyl]propanal directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methyl-2-[(4-methylphenyl)sulfanyl]propanal?
Yes, KEHONG BIO provides custom synthesis services for 2-Methyl-2-[(4-methylphenyl)sulfanyl]propanal and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.