1-Penten-3-one, 1,2-dihydroxy-5-(methylthio)-
TL;DR: 1-Penten-3-one, 1,2-dihydroxy-5-(methylthio)- (CAS 151169-51-6) is a chemical compound with molecular formula C6H10O3S and molecular weight 162.03506 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,2-dihydroxy-5-methylsulfanylpent-1-en-3-one
Also Known As: 1-Penten-3-one, 1,2-dihydroxy-5-(methylthio)-, 1,2-dihydroxy-3-keto-5-methylthiopentene, 1,2-dihydroxy-5-methylsulfanylpent-1-en-3-one, 4-Methoxymethoxy-3,5-di-tert-butylbenzaldehyde, 1,2-dihydroxy-5-(methylsulfanyl)pent-1-en-3-one
Technical Specifications
| Molecular Formula | C6H10O3S |
| Molecular Weight | 162.03506 g/mol |
| XLogP | 0.8 |
| Topological Polar Surface Area (TPSA) | 82.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 162.03506 Da |
| Heavy Atoms | 10 |
| Complexity | 142.0 |
| SMILES | CSCCC(=O)C(=CO)O |
| InChIKey | CILXJJLQPTUUSS-UHFFFAOYSA-N |
Chemical Property Profile of 1-Penten-3-one, 1,2-dihydroxy-5-(methylthio)-
Property Insights of 1-Penten-3-one, 1,2-dihydroxy-5-(methylthio)-
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Penten-3-one, 1,2-dihydroxy-5-(methylthio)-. The TPSA of 82.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Penten-3-one, 1,2-dihydroxy-5-(methylthio)-. Following Lipinski's Rule of Five, 1-Penten-3-one, 1,2-dihydroxy-5-(methylthio)- 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
What is the CAS number of 1-Penten-3-one, 1,2-dihydroxy-5-(methylthio)-?
The CAS number of 1-Penten-3-one, 1,2-dihydroxy-5-(methylthio)- is 151169-51-6.
What is the molecular formula of 1-Penten-3-one, 1,2-dihydroxy-5-(methylthio)-?
The molecular formula of 1-Penten-3-one, 1,2-dihydroxy-5-(methylthio)- is C6H10O3S.
What is the molecular weight of 1-Penten-3-one, 1,2-dihydroxy-5-(methylthio)-?
The molecular weight of 1-Penten-3-one, 1,2-dihydroxy-5-(methylthio)- is 162.03506 g/mol.
Where can I buy 1-Penten-3-one, 1,2-dihydroxy-5-(methylthio)-?
You can request a quote for 1-Penten-3-one, 1,2-dihydroxy-5-(methylthio)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-Penten-3-one, 1,2-dihydroxy-5-(methylthio)-?
Yes, CoreyChem provides custom synthesis services for 1-Penten-3-one, 1,2-dihydroxy-5-(methylthio)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.