4-Methylsulfonylacetophenone
TL;DR: 4-Methylsulfonylacetophenone (CAS 10297-73-1) is a chemical compound with molecular formula C9H10O3S and molecular weight 198.03506 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(4-methylsulfonylphenyl)ethanone
Also Known As: 4'-(Methylsulfonyl)acetophenone, 4-(Methylsulfonyl)acetophenone, 1-(4-(Methylsulfonyl)phenyl)ethanone, 4-METHYLSULFONYLACETOPHENONE, 1-(4-methylsulfonylphenyl)ethanone
Application Areas
Top 5 of 9 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C9H10O3S |
| Molecular Weight | 198.03506 g/mol |
| XLogP | 0.9 |
| Topological Polar Surface Area (TPSA) | 59.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 198.03506 Da |
| Heavy Atoms | 13 |
| Complexity | 278.0 |
| SMILES | CC(=O)C1=CC=C(C=C1)S(=O)(=O)C |
| InChIKey | KAVZYDHKJNABPC-UHFFFAOYSA-N |
Chemical Property Profile of 4-Methylsulfonylacetophenone
Property Insights of 4-Methylsulfonylacetophenone
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Methylsulfonylacetophenone. With a topological polar surface area (TPSA) of 59.6 Ų, 4-Methylsulfonylacetophenone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Methylsulfonylacetophenone 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
What is the CAS number of 4-Methylsulfonylacetophenone?
The CAS number of 4-Methylsulfonylacetophenone is 10297-73-1.
What is the molecular formula of 4-Methylsulfonylacetophenone?
The molecular formula of 4-Methylsulfonylacetophenone is C9H10O3S.
What is the molecular weight of 4-Methylsulfonylacetophenone?
The molecular weight of 4-Methylsulfonylacetophenone is 198.03506 g/mol.
Where can I buy 4-Methylsulfonylacetophenone?
You can request a quote for 4-Methylsulfonylacetophenone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-Methylsulfonylacetophenone?
Yes, CoreyChem provides custom synthesis services for 4-Methylsulfonylacetophenone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.