Ethanone, 2,2-dihydroxy-1-(4-(propylthio)phenyl)-
TL;DR: Ethanone, 2,2-dihydroxy-1-(4-(propylthio)phenyl)- (CAS 53066-75-4) is a chemical compound with molecular formula C11H14O3S and molecular weight 226.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2-dihydroxy-1-(4-propylsulfanylphenyl)ethanone
Also Known As: 4-Propylthiophenylglyoxal, Ethanone, 2,2-dihydroxy-1-(4-(propylthio)phenyl)-, 2,2-Dihydroxy-1-(4-(propylthio)phenyl)ethanone, 2,2-dihydroxy-1-(4-propylsulfanylphenyl)ethanone, 2,2-Dihydroxy-1-[4-(propylsulfanyl)phenyl]ethan-1-one
| Molecular Formula | C11H14O3S |
|---|---|
| Molecular Weight | 226.07 g/mol |
| LogP | 1.6821 |
| Topological Polar Surface Area | 57.53 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 226.06636 |
| Heavy Atoms | 15 |
| Complexity | 319.10986 |
Chemical Identifiers
| CAS Number | 53066-75-4 |
|---|---|
| SMILES | CCCSC1=CC=C(C=C1)C(=O)C(O)O |
Product Overview
Ethanone, 2,2-dihydroxy-1-(4-(propylthio)phenyl)- (CAS 53066-75-4), with molecular formula C11H14O3S and molecular weight 226.07 g/mol. IUPAC: 2,2-dihydroxy-1-(4-propylsulfanylphenyl)ethanone.
Chemical Property Profile of Ethanone, 2,2-dihydroxy-1-(4-(propylthio)phenyl)-
Property Insights of Ethanone, 2,2-dihydroxy-1-(4-(propylthio)phenyl)-
The XLogP value of 1.6821 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethanone, 2,2-dihydroxy-1-(4-(propylthio)phenyl)-. With a topological polar surface area (TPSA) of 57.53 Ų, Ethanone, 2,2-dihydroxy-1-(4-(propylthio)phenyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethanone, 2,2-dihydroxy-1-(4-(propylthio)phenyl)- has 2 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 Ethanone, 2,2-dihydroxy-1-(4-(propylthio)phenyl)-?
The CAS number of Ethanone, 2,2-dihydroxy-1-(4-(propylthio)phenyl)- is 53066-75-4.
What is the molecular formula of Ethanone, 2,2-dihydroxy-1-(4-(propylthio)phenyl)-?
The molecular formula of Ethanone, 2,2-dihydroxy-1-(4-(propylthio)phenyl)- is C11H14O3S.
What is the molecular weight of Ethanone, 2,2-dihydroxy-1-(4-(propylthio)phenyl)-?
The molecular weight of Ethanone, 2,2-dihydroxy-1-(4-(propylthio)phenyl)- is 226.07 g/mol.
Where can I buy Ethanone, 2,2-dihydroxy-1-(4-(propylthio)phenyl)-?
You can request a quote for Ethanone, 2,2-dihydroxy-1-(4-(propylthio)phenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethanone, 2,2-dihydroxy-1-(4-(propylthio)phenyl)-?
Yes, KEHONG BIO provides custom synthesis services for Ethanone, 2,2-dihydroxy-1-(4-(propylthio)phenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.