(3S,4R)-3,4-dihydroxypentan-2-one
TL;DR: (3S,4R)-3,4-dihydroxypentan-2-one (CAS 118994-78-8) is a chemical compound with molecular formula C5H10O3 and molecular weight 118.062996 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3S,4R)-3,4-dihydroxypentan-2-one
Also Known As: NCIStruc1_000264, (3S,4R)-3,4-dihydroxypentan-2-one, NCIStruc2_000070, 2-Pentanone, 3,4-dihydroxy-, [S-(R*,S*)]- (9CI)
Technical Specifications
| Molecular Formula | C5H10O3 |
| Molecular Weight | 118.062996 g/mol |
| XLogP | -0.9 |
| Topological Polar Surface Area (TPSA) | 57.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 118.062996 Da |
| Heavy Atoms | 8 |
| Complexity | 89.0 |
| SMILES | C[C@H]([C@@H](C(=O)C)O)O |
| InChIKey | FFYGQZADJGVPGT-WUJLRWPWSA-N |
Chemical Property Profile of (3S,4R)-3,4-dihydroxypentan-2-one
Property Insights of (3S,4R)-3,4-dihydroxypentan-2-one
The XLogP value of -0.9 indicates that (3S,4R)-3,4-dihydroxypentan-2-one is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 57.5 Ų, (3S,4R)-3,4-dihydroxypentan-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3S,4R)-3,4-dihydroxypentan-2-one has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of (3S,4R)-3,4-dihydroxypentan-2-one?
The CAS number of (3S,4R)-3,4-dihydroxypentan-2-one is 118994-78-8.
What is the molecular formula of (3S,4R)-3,4-dihydroxypentan-2-one?
The molecular formula of (3S,4R)-3,4-dihydroxypentan-2-one is C5H10O3.
What is the molecular weight of (3S,4R)-3,4-dihydroxypentan-2-one?
The molecular weight of (3S,4R)-3,4-dihydroxypentan-2-one is 118.062996 g/mol.
Where can I buy (3S,4R)-3,4-dihydroxypentan-2-one?
You can request a quote for (3S,4R)-3,4-dihydroxypentan-2-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (3S,4R)-3,4-dihydroxypentan-2-one?
Yes, CoreyChem provides custom synthesis services for (3S,4R)-3,4-dihydroxypentan-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.