![1-Propanone, 3-[[(methylthio)methyl]sulfonyl]-1-phenyl- structure](/static/products/5503/55030-38-1.webp)
1-Propanone, 3-[[(methylthio)methyl]sulfonyl]-1-phenyl-
TL;DR: 1-Propanone, 3-[[(methylthio)methyl]sulfonyl]-1-phenyl- (CAS 55030-38-1) is a chemical compound with molecular formula C11H14O3S2 and molecular weight 258.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(methylsulfanylmethylsulfonyl)-1-phenylpropan-1-one
Also Known As: 1-Propanone, 3-[[(methylthio)methyl]sulfonyl]-1-phenyl-, beta-[[(Methylthio)methyl]sulfonyl]propiophenone, beta-[[(methylthio)methyl ]sulfonyl ]propiophenone, 3-(methylsulfanyl)methanesulfonyl-1-phenylpropan-1-one, 3-(methylsulfanylmethylsulfonyl)-1-phenylpropan-1-one
| Molecular Formula | C11H14O3S2 |
|---|---|
| Molecular Weight | 258.04 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 84.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 258.03842 |
| Heavy Atoms | 16 |
| Complexity | 311.0 |
Chemical Identifiers
| CAS Number | 55030-38-1 |
|---|---|
| SMILES | CSCS(=O)(=O)CCC(=O)C1=CC=CC=C1 |
| InChIKey | LCQZJYOSVBAIQA-UHFFFAOYSA-N |
Product Overview
1-Propanone, 3-[[(methylthio)methyl]sulfonyl]-1-phenyl- (CAS 55030-38-1), with molecular formula C11H14O3S2 and molecular weight 258.04 g/mol. IUPAC: 3-(methylsulfanylmethylsulfonyl)-1-phenylpropan-1-one.
Chemical Property Profile of 1-Propanone, 3-[[(methylthio)methyl]sulfonyl]-1-phenyl-
Property Insights of 1-Propanone, 3-[[(methylthio)methyl]sulfonyl]-1-phenyl-
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Propanone, 3-[[(methylthio)methyl]sulfonyl]-1-phenyl-. The TPSA of 84.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Propanone, 3-[[(methylthio)methyl]sulfonyl]-1-phenyl-. Following Lipinski's Rule of Five, 1-Propanone, 3-[[(methylthio)methyl]sulfonyl]-1-phenyl- has 0 hydrogen bond donor(s) and 4 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 1-Propanone, 3-[[(methylthio)methyl]sulfonyl]-1-phenyl-?
The CAS number of 1-Propanone, 3-[[(methylthio)methyl]sulfonyl]-1-phenyl- is 55030-38-1.
What is the molecular formula of 1-Propanone, 3-[[(methylthio)methyl]sulfonyl]-1-phenyl-?
The molecular formula of 1-Propanone, 3-[[(methylthio)methyl]sulfonyl]-1-phenyl- is C11H14O3S2.
What is the molecular weight of 1-Propanone, 3-[[(methylthio)methyl]sulfonyl]-1-phenyl-?
The molecular weight of 1-Propanone, 3-[[(methylthio)methyl]sulfonyl]-1-phenyl- is 258.04 g/mol.
Where can I buy 1-Propanone, 3-[[(methylthio)methyl]sulfonyl]-1-phenyl-?
You can request a quote for 1-Propanone, 3-[[(methylthio)methyl]sulfonyl]-1-phenyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Propanone, 3-[[(methylthio)methyl]sulfonyl]-1-phenyl-?
Yes, KEHONG BIO provides custom synthesis services for 1-Propanone, 3-[[(methylthio)methyl]sulfonyl]-1-phenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.