2-Hydroxy-5-(methylsulfanyl)-3-oxopent-1-enyl phosphate
TL;DR: 2-Hydroxy-5-(methylsulfanyl)-3-oxopent-1-enyl phosphate (CAS 629647-81-0) is a chemical compound with molecular formula C6H11O6PS and molecular weight 242.0014 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2-hydroxy-5-methylsulfanyl-3-oxopent-1-enyl) dihydrogen phosphate
Also Known As: 1-Penten-3-one, 2-hydroxy-5-(methylthio)-1-(phosphonooxy)-, 2-Hydroxy-5-(methylthio)-3-oxopent-1-enyl phosphate, 2-hydroxy-5-(methylsulfanyl)-3-oxopent-1-enyl phosphate, (2-hydroxy-5-methylsulfanyl-3-oxopent-1-enyl) dihydrogen phosphate, 2-hydroxy-5-(methylsulfanyl)-3-oxopent-1-en-1-yl dihydrogen phosphate
Technical Specifications
| Molecular Formula | C6H11O6PS |
| Molecular Weight | 242.0014 g/mol |
| XLogP | -1.0 |
| Topological Polar Surface Area (TPSA) | 129.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 242.0014 Da |
| Heavy Atoms | 14 |
| Complexity | 269.0 |
| SMILES | CSCCC(=O)C(=COP(=O)(O)O)O |
| InChIKey | YIEMFVNCENFBSD-UHFFFAOYSA-N |
Product Description
Applications: 2-Hydroxy-5-(methylsulfanyl)-3-oxopent-1-enyl phosphate is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
2-Hydroxy-5-(methylsulfanyl)-3-oxopent-1-enyl phosphate is a fine chemical identified by CAS number 629647-81-0 and the molecular formula C6H11O6PS and a molecular weight of 242 g/mol. Synonyms include 1-Penten-3-one, 2-hydroxy-5-(methylthio)-1-(phosphonooxy)- and 2-Hydroxy-5-(methylthio)-3-oxopent-1-enyl phosphate.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of 2-Hydroxy-5-(methylsulfanyl)-3-oxopent-1-enyl phosphate
Property Insights of 2-Hydroxy-5-(methylsulfanyl)-3-oxopent-1-enyl phosphate
The XLogP value of -1.0 indicates that 2-Hydroxy-5-(methylsulfanyl)-3-oxopent-1-enyl phosphate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 129.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Hydroxy-5-(methylsulfanyl)-3-oxopent-1-enyl phosphate. Following Lipinski's Rule of Five, 2-Hydroxy-5-(methylsulfanyl)-3-oxopent-1-enyl phosphate has 3 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-Hydroxy-5-(methylsulfanyl)-3-oxopent-1-enyl phosphate?
The CAS number of 2-Hydroxy-5-(methylsulfanyl)-3-oxopent-1-enyl phosphate is 629647-81-0.
What is the molecular formula of 2-Hydroxy-5-(methylsulfanyl)-3-oxopent-1-enyl phosphate?
The molecular formula of 2-Hydroxy-5-(methylsulfanyl)-3-oxopent-1-enyl phosphate is C6H11O6PS.
What is the molecular weight of 2-Hydroxy-5-(methylsulfanyl)-3-oxopent-1-enyl phosphate?
The molecular weight of 2-Hydroxy-5-(methylsulfanyl)-3-oxopent-1-enyl phosphate is 242.0014 g/mol.
What are the applications of 2-Hydroxy-5-(methylsulfanyl)-3-oxopent-1-enyl phosphate?
2-Hydroxy-5-(methylsulfanyl)-3-oxopent-1-enyl phosphate is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical...
Where can I buy 2-Hydroxy-5-(methylsulfanyl)-3-oxopent-1-enyl phosphate?
You can request a quote for 2-Hydroxy-5-(methylsulfanyl)-3-oxopent-1-enyl phosphate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Hydroxy-5-(methylsulfanyl)-3-oxopent-1-enyl phosphate?
Yes, CoreyChem provides custom synthesis services for 2-Hydroxy-5-(methylsulfanyl)-3-oxopent-1-enyl phosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.