3-Methyl-5-propionyl-1,2,4-cyclopentanetrione
TL;DR: 3-Methyl-5-propionyl-1,2,4-cyclopentanetrione (CAS 57174-14-8) is a chemical compound with molecular formula C9H10O4 and molecular weight 182.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-5-propanoylcyclopentane-1,2,4-trione
Also Known As: 3-methyl-5-propanoylcyclopentane-1,2,4-trione, 3-Methyl-5-propionyl-1,2,4-cyclopentanetrione, 3-Propionyl-5-methyl-1,2,4-cyclopentane-trione, 1,2,4-Cyclopentanetrione, 3-methyl-5-(1-oxopropyl)-, 3-Methyl-5-propionyl-1,2,4-cyclopentanetrione #
| Molecular Formula | C9H10O4 |
|---|---|
| Molecular Weight | 182.06 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 68.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 182.0579 |
| Heavy Atoms | 13 |
| Complexity | 303.0 |
Chemical Identifiers
| CAS Number | 57174-14-8 |
|---|---|
| SMILES | CCC(=O)C1C(=O)C(C(=O)C1=O)C |
| InChIKey | UHAPRFPYFHXIFS-UHFFFAOYSA-N |
Product Overview
3-Methyl-5-propionyl-1,2,4-cyclopentanetrione (CAS 57174-14-8), with molecular formula C9H10O4 and molecular weight 182.06 g/mol. IUPAC: 3-methyl-5-propanoylcyclopentane-1,2,4-trione.
Chemical Property Profile of 3-Methyl-5-propionyl-1,2,4-cyclopentanetrione
Property Insights of 3-Methyl-5-propionyl-1,2,4-cyclopentanetrione
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Methyl-5-propionyl-1,2,4-cyclopentanetrione. The TPSA of 68.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Methyl-5-propionyl-1,2,4-cyclopentanetrione. Following Lipinski's Rule of Five, 3-Methyl-5-propionyl-1,2,4-cyclopentanetrione has 0 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-Methyl-5-propionyl-1,2,4-cyclopentanetrione?
The CAS number of 3-Methyl-5-propionyl-1,2,4-cyclopentanetrione is 57174-14-8.
What is the molecular formula of 3-Methyl-5-propionyl-1,2,4-cyclopentanetrione?
The molecular formula of 3-Methyl-5-propionyl-1,2,4-cyclopentanetrione is C9H10O4.
What is the molecular weight of 3-Methyl-5-propionyl-1,2,4-cyclopentanetrione?
The molecular weight of 3-Methyl-5-propionyl-1,2,4-cyclopentanetrione is 182.06 g/mol.
Where can I buy 3-Methyl-5-propionyl-1,2,4-cyclopentanetrione?
You can request a quote for 3-Methyl-5-propionyl-1,2,4-cyclopentanetrione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methyl-5-propionyl-1,2,4-cyclopentanetrione?
Yes, KEHONG BIO provides custom synthesis services for 3-Methyl-5-propionyl-1,2,4-cyclopentanetrione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.