![[Acetyloxy-(4-methylsulfonylphenyl)methyl] acetate structure](/static/products/100/100118-64-7.png)
[Acetyloxy-(4-methylsulfonylphenyl)methyl] acetate
TL;DR: [Acetyloxy-(4-methylsulfonylphenyl)methyl] acetate (CAS 100118-64-7) is a chemical compound with molecular formula C12H14O6S and molecular weight 286.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[acetyloxy-(4-methylsulfonylphenyl)methyl] acetate
Also Known As: Maybridge3_004299, 1-diacetoxymethyl-4-methanesulfonyl-benzene, IDI1_015686, [acetyloxy-(4-methylsulfonylphenyl)methyl] acetate
| Molecular Formula | C12H14O6S |
|---|---|
| Molecular Weight | 286.05 g/mol |
| LogP | 1.2149 |
| Topological Polar Surface Area | 86.74 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 286.05112 |
| Heavy Atoms | 19 |
| Complexity | 556.7421 |
Chemical Identifiers
| CAS Number | 100118-64-7 |
|---|---|
| SMILES | CC(=O)OC(C1=CC=C(C=C1)S(=O)(=O)C)OC(=O)C |
Product Overview
[Acetyloxy-(4-methylsulfonylphenyl)methyl] acetate (CAS 100118-64-7), with molecular formula C12H14O6S and molecular weight 286.05 g/mol. IUPAC: [acetyloxy-(4-methylsulfonylphenyl)methyl] acetate.
Chemical Property Profile of [Acetyloxy-(4-methylsulfonylphenyl)methyl] acetate
Property Insights of [Acetyloxy-(4-methylsulfonylphenyl)methyl] acetate
The XLogP value of 1.2149 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [Acetyloxy-(4-methylsulfonylphenyl)methyl] acetate. The TPSA of 86.74 Ų falls within the moderate polarity range, balancing permeability and solubility for [Acetyloxy-(4-methylsulfonylphenyl)methyl] acetate. Following Lipinski's Rule of Five, [Acetyloxy-(4-methylsulfonylphenyl)methyl] acetate has 0 hydrogen bond donor(s) and 6 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 [Acetyloxy-(4-methylsulfonylphenyl)methyl] acetate?
The CAS number of [Acetyloxy-(4-methylsulfonylphenyl)methyl] acetate is 100118-64-7.
What is the molecular formula of [Acetyloxy-(4-methylsulfonylphenyl)methyl] acetate?
The molecular formula of [Acetyloxy-(4-methylsulfonylphenyl)methyl] acetate is C12H14O6S.
What is the molecular weight of [Acetyloxy-(4-methylsulfonylphenyl)methyl] acetate?
The molecular weight of [Acetyloxy-(4-methylsulfonylphenyl)methyl] acetate is 286.05 g/mol.
Where can I buy [Acetyloxy-(4-methylsulfonylphenyl)methyl] acetate?
You can request a quote for [Acetyloxy-(4-methylsulfonylphenyl)methyl] acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [Acetyloxy-(4-methylsulfonylphenyl)methyl] acetate?
Yes, KEHONG BIO provides custom synthesis services for [Acetyloxy-(4-methylsulfonylphenyl)methyl] acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.