1,2-Dihydroxy-5-(methylthio)pent-1-en-3-one
TL;DR: 1,2-Dihydroxy-5-(methylthio)pent-1-en-3-one (CAS 746507-19-7) is a chemical compound with molecular formula C6H10O3S and molecular weight 162.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(Z)-1,2-dihydroxy-5-methylsulfanylpent-1-en-3-one
Also Known As: acireductone, 1,2-Dihydroxy-5-(methylthio)pent-1-en-3-one, (Z)-1,2-dihydroxy-5-methylsulfanylpent-1-en-3-one, 1,2-dihydroxy-3-keto-5-methylthiopentene, 1,2-dihydroxy-5-(methylsulfanyl)pent-1-en-3-one
| Molecular Formula | C6H10O3S |
|---|---|
| Molecular Weight | 162.04 g/mol |
| LogP | 1.266 |
| Topological Polar Surface Area | 57.53 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 162.03506 |
| Heavy Atoms | 10 |
| Complexity | 141.92836 |
Chemical Identifiers
| CAS Number | 746507-19-7 |
|---|---|
| SMILES | CSCCC(=O)/C(=C/O)/O |
Product Overview
1,2-Dihydroxy-5-(methylthio)pent-1-en-3-one (CAS 746507-19-7), with molecular formula C6H10O3S and molecular weight 162.04 g/mol. IUPAC: (Z)-1,2-dihydroxy-5-methylsulfanylpent-1-en-3-one.
Chemical Property Profile of 1,2-Dihydroxy-5-(methylthio)pent-1-en-3-one
Property Insights of 1,2-Dihydroxy-5-(methylthio)pent-1-en-3-one
The XLogP value of 1.266 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2-Dihydroxy-5-(methylthio)pent-1-en-3-one. With a topological polar surface area (TPSA) of 57.53 Ų, 1,2-Dihydroxy-5-(methylthio)pent-1-en-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2-Dihydroxy-5-(methylthio)pent-1-en-3-one 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 1,2-Dihydroxy-5-(methylthio)pent-1-en-3-one?
The CAS number of 1,2-Dihydroxy-5-(methylthio)pent-1-en-3-one is 746507-19-7.
What is the molecular formula of 1,2-Dihydroxy-5-(methylthio)pent-1-en-3-one?
The molecular formula of 1,2-Dihydroxy-5-(methylthio)pent-1-en-3-one is C6H10O3S.
What is the molecular weight of 1,2-Dihydroxy-5-(methylthio)pent-1-en-3-one?
The molecular weight of 1,2-Dihydroxy-5-(methylthio)pent-1-en-3-one is 162.04 g/mol.
Where can I buy 1,2-Dihydroxy-5-(methylthio)pent-1-en-3-one?
You can request a quote for 1,2-Dihydroxy-5-(methylthio)pent-1-en-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2-Dihydroxy-5-(methylthio)pent-1-en-3-one?
Yes, KEHONG BIO provides custom synthesis services for 1,2-Dihydroxy-5-(methylthio)pent-1-en-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.