![Methyl 2-methyl-2-[4-(4-methylsulfonyloxybut-1-ynyl)phenyl]propanoate structure](/static/products/1020/1020719-58-7.webp)
Methyl 2-methyl-2-[4-(4-methylsulfonyloxybut-1-ynyl)phenyl]propanoate
TL;DR: Methyl 2-methyl-2-[4-(4-methylsulfonyloxybut-1-ynyl)phenyl]propanoate (CAS 1020719-58-7) is a chemical compound with molecular formula C16H20O5S and molecular weight 324.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-methyl-2-[4-(4-methylsulfonyloxybut-1-ynyl)phenyl]propanoate
Also Known As: starbld0002613, Methyl 2-methyl-2-[4-(4-methylsulfonyloxybut-1-ynyl)phenyl]propanoate, 4-[4-(Methanesulfonyloxy)-1-butynyl]-alpha,alpha-di(methyl)benzeneacetic Acid, Methyl Ester, methyl 2-methyl-2-(4-(4-((methylsulfonyl)oxy)but-1-yn-1-yl)phenyl)propanoate, 2-[4-(4-Methanesulfonyloxy-but-1-ynyl)-phenyl]-2-methyl-propionic acid methyl ester
| Molecular Formula | C16H20O5S |
|---|---|
| Molecular Weight | 324.10 g/mol |
| LogP | 1.855 |
| Topological Polar Surface Area | 69.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 324.10315 |
| Heavy Atoms | 22 |
| Complexity | 675.48663 |
Chemical Identifiers
| CAS Number | 1020719-58-7 |
|---|---|
| SMILES | CC(C)(C1=CC=C(C=C1)C#CCCOS(=O)(=O)C)C(=O)OC |
Product Overview
Methyl 2-methyl-2-[4-(4-methylsulfonyloxybut-1-ynyl)phenyl]propanoate (CAS 1020719-58-7), with molecular formula C16H20O5S and molecular weight 324.10 g/mol. IUPAC: methyl 2-methyl-2-[4-(4-methylsulfonyloxybut-1-ynyl)phenyl]propanoate.
Chemical Property Profile of Methyl 2-methyl-2-[4-(4-methylsulfonyloxybut-1-ynyl)phenyl]propanoate
Property Insights of Methyl 2-methyl-2-[4-(4-methylsulfonyloxybut-1-ynyl)phenyl]propanoate
The XLogP value of 1.855 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-methyl-2-[4-(4-methylsulfonyloxybut-1-ynyl)phenyl]propanoate. The TPSA of 69.67 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-methyl-2-[4-(4-methylsulfonyloxybut-1-ynyl)phenyl]propanoate. Following Lipinski's Rule of Five, Methyl 2-methyl-2-[4-(4-methylsulfonyloxybut-1-ynyl)phenyl]propanoate has 0 hydrogen bond donor(s) and 5 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 Methyl 2-methyl-2-[4-(4-methylsulfonyloxybut-1-ynyl)phenyl]propanoate?
The CAS number of Methyl 2-methyl-2-[4-(4-methylsulfonyloxybut-1-ynyl)phenyl]propanoate is 1020719-58-7.
What is the molecular formula of Methyl 2-methyl-2-[4-(4-methylsulfonyloxybut-1-ynyl)phenyl]propanoate?
The molecular formula of Methyl 2-methyl-2-[4-(4-methylsulfonyloxybut-1-ynyl)phenyl]propanoate is C16H20O5S.
What is the molecular weight of Methyl 2-methyl-2-[4-(4-methylsulfonyloxybut-1-ynyl)phenyl]propanoate?
The molecular weight of Methyl 2-methyl-2-[4-(4-methylsulfonyloxybut-1-ynyl)phenyl]propanoate is 324.10 g/mol.
Where can I buy Methyl 2-methyl-2-[4-(4-methylsulfonyloxybut-1-ynyl)phenyl]propanoate?
You can request a quote for Methyl 2-methyl-2-[4-(4-methylsulfonyloxybut-1-ynyl)phenyl]propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-methyl-2-[4-(4-methylsulfonyloxybut-1-ynyl)phenyl]propanoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-methyl-2-[4-(4-methylsulfonyloxybut-1-ynyl)phenyl]propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.