![1-Propanone, 2-[[(4-methylphenyl)sulfonyl]oxy]-1-phenyl- structure](/static/products/874/87456-64-2.png)
1-Propanone, 2-[[(4-methylphenyl)sulfonyl]oxy]-1-phenyl-
TL;DR: 1-Propanone, 2-[[(4-methylphenyl)sulfonyl]oxy]-1-phenyl- (CAS 87456-64-2) is a chemical compound with molecular formula C16H16O4S and molecular weight 304.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1-oxo-1-phenylpropan-2-yl) 4-methylbenzenesulfonate
Also Known As: alpha-Tosyloxypropiophenone, alpha-(Tosyloxy)propiophenone, 1-Phenyl-2-(tosyloxy)-1-propanone, p-Toluenesulfonic acid 1-benzoylethyl ester, J1.002.663F
| Molecular Formula | C16H16O4S |
|---|---|
| Molecular Weight | 304.08 g/mol |
| LogP | 2.97172 |
| Topological Polar Surface Area | 60.44 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 304.07693 |
| Heavy Atoms | 21 |
| Complexity | 718.6321 |
Chemical Identifiers
| CAS Number | 87456-64-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)OC(C)C(=O)C2=CC=CC=C2 |
Product Overview
1-Propanone, 2-[[(4-methylphenyl)sulfonyl]oxy]-1-phenyl- (CAS 87456-64-2), with molecular formula C16H16O4S and molecular weight 304.08 g/mol. IUPAC: (1-oxo-1-phenylpropan-2-yl) 4-methylbenzenesulfonate.
Chemical Property Profile of 1-Propanone, 2-[[(4-methylphenyl)sulfonyl]oxy]-1-phenyl-
Property Insights of 1-Propanone, 2-[[(4-methylphenyl)sulfonyl]oxy]-1-phenyl-
The XLogP value of 2.97172 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Propanone, 2-[[(4-methylphenyl)sulfonyl]oxy]-1-phenyl-. The TPSA of 60.44 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Propanone, 2-[[(4-methylphenyl)sulfonyl]oxy]-1-phenyl-. Following Lipinski's Rule of Five, 1-Propanone, 2-[[(4-methylphenyl)sulfonyl]oxy]-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, 2-[[(4-methylphenyl)sulfonyl]oxy]-1-phenyl-?
The CAS number of 1-Propanone, 2-[[(4-methylphenyl)sulfonyl]oxy]-1-phenyl- is 87456-64-2.
What is the molecular formula of 1-Propanone, 2-[[(4-methylphenyl)sulfonyl]oxy]-1-phenyl-?
The molecular formula of 1-Propanone, 2-[[(4-methylphenyl)sulfonyl]oxy]-1-phenyl- is C16H16O4S.
What is the molecular weight of 1-Propanone, 2-[[(4-methylphenyl)sulfonyl]oxy]-1-phenyl-?
The molecular weight of 1-Propanone, 2-[[(4-methylphenyl)sulfonyl]oxy]-1-phenyl- is 304.08 g/mol.
Where can I buy 1-Propanone, 2-[[(4-methylphenyl)sulfonyl]oxy]-1-phenyl-?
You can request a quote for 1-Propanone, 2-[[(4-methylphenyl)sulfonyl]oxy]-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, 2-[[(4-methylphenyl)sulfonyl]oxy]-1-phenyl-?
Yes, KEHONG BIO provides custom synthesis services for 1-Propanone, 2-[[(4-methylphenyl)sulfonyl]oxy]-1-phenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.