3-Hydroxy-3-methyl-5-oxopentanoic acid
TL;DR: 3-Hydroxy-3-methyl-5-oxopentanoic acid (CAS 76022-68-9) is a chemical compound with molecular formula C6H10O4 and molecular weight 146.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-hydroxy-3-methyl-5-oxopentanoic acid
Also Known As: Mevaldic acid, 3-hydroxy-3-methyl-5-oxopentanoic acid, (3RS)-MEVALDATE, <2-14C>-Mevaldinsaeure, MEVALDIC ACID [MI]
| Molecular Formula | C6H10O4 |
|---|---|
| Molecular Weight | 146.06 g/mol |
| LogP | -1.3 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 146.0579 |
| Heavy Atoms | 10 |
| Complexity | 143.0 |
Chemical Identifiers
| CAS Number | 76022-68-9 |
|---|---|
| SMILES | CC(CC=O)(CC(=O)O)O |
| InChIKey | CWCYSIIDJAVQSK-UHFFFAOYSA-N |
Product Overview
3-Hydroxy-3-methyl-5-oxopentanoic acid (CAS 76022-68-9), with molecular formula C6H10O4 and molecular weight 146.06 g/mol. IUPAC: 3-hydroxy-3-methyl-5-oxopentanoic acid.
Chemical Property Profile of 3-Hydroxy-3-methyl-5-oxopentanoic acid
Property Insights of 3-Hydroxy-3-methyl-5-oxopentanoic acid
The XLogP value of -1.3 indicates that 3-Hydroxy-3-methyl-5-oxopentanoic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Hydroxy-3-methyl-5-oxopentanoic acid. Following Lipinski's Rule of Five, 3-Hydroxy-3-methyl-5-oxopentanoic acid 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 3-Hydroxy-3-methyl-5-oxopentanoic acid?
The CAS number of 3-Hydroxy-3-methyl-5-oxopentanoic acid is 76022-68-9.
What is the molecular formula of 3-Hydroxy-3-methyl-5-oxopentanoic acid?
The molecular formula of 3-Hydroxy-3-methyl-5-oxopentanoic acid is C6H10O4.
What is the molecular weight of 3-Hydroxy-3-methyl-5-oxopentanoic acid?
The molecular weight of 3-Hydroxy-3-methyl-5-oxopentanoic acid is 146.06 g/mol.
Where can I buy 3-Hydroxy-3-methyl-5-oxopentanoic acid?
You can request a quote for 3-Hydroxy-3-methyl-5-oxopentanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Hydroxy-3-methyl-5-oxopentanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-Hydroxy-3-methyl-5-oxopentanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.