5-Ethyl-2-hydroxy-3-methylcyclopent-2-en-1-one
TL;DR: 5-Ethyl-2-hydroxy-3-methylcyclopent-2-en-1-one (CAS 53263-58-4) is a chemical compound with molecular formula C8H12O2 and molecular weight 140.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-ethyl-2-hydroxy-3-methylcyclopent-2-en-1-one
Also Known As: Ethylcyclotene, 5-Ethyl-2-hydroxy-3-methylcyclopent-2-en-1-one, 5-Ethyl-3-methylcyclotene, FEMA No. 3454, 5-Ethyl-3-methyl cyclotene
| Molecular Formula | C8H12O2 |
|---|---|
| Molecular Weight | 140.08 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 140.08372 |
| Heavy Atoms | 10 |
| Complexity | 191.0 |
| Density | 1.053-1.060 |
| Solubility | slightly soluble in water; soluble in ethanol, fat, propylene glycol |
| Refractive Index | 1.478-1.484 |
Chemical Identifiers
| CAS Number | 53263-58-4 |
|---|---|
| SMILES | CCC1CC(=C(C1=O)O)C |
| InChIKey | ARHWUYVUNJLMRR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-Ethyl-2-hydroxy-3-methylcyclopent-2-en-1-one (CAS 53263-58-4), with molecular formula C8H12O2 and molecular weight 140.08 g/mol. IUPAC: 5-ethyl-2-hydroxy-3-methylcyclopent-2-en-1-one.
Chemical Property Profile of 5-Ethyl-2-hydroxy-3-methylcyclopent-2-en-1-one
Property Insights of 5-Ethyl-2-hydroxy-3-methylcyclopent-2-en-1-one
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Ethyl-2-hydroxy-3-methylcyclopent-2-en-1-one. With a topological polar surface area (TPSA) of 37.3 Ų, 5-Ethyl-2-hydroxy-3-methylcyclopent-2-en-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Ethyl-2-hydroxy-3-methylcyclopent-2-en-1-one has 1 hydrogen bond donor(s) and 2 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 5-Ethyl-2-hydroxy-3-methylcyclopent-2-en-1-one?
The CAS number of 5-Ethyl-2-hydroxy-3-methylcyclopent-2-en-1-one is 53263-58-4.
What is the molecular formula of 5-Ethyl-2-hydroxy-3-methylcyclopent-2-en-1-one?
The molecular formula of 5-Ethyl-2-hydroxy-3-methylcyclopent-2-en-1-one is C8H12O2.
What is the molecular weight of 5-Ethyl-2-hydroxy-3-methylcyclopent-2-en-1-one?
The molecular weight of 5-Ethyl-2-hydroxy-3-methylcyclopent-2-en-1-one is 140.08 g/mol.
Where can I buy 5-Ethyl-2-hydroxy-3-methylcyclopent-2-en-1-one?
You can request a quote for 5-Ethyl-2-hydroxy-3-methylcyclopent-2-en-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Ethyl-2-hydroxy-3-methylcyclopent-2-en-1-one?
Yes, KEHONG BIO provides custom synthesis services for 5-Ethyl-2-hydroxy-3-methylcyclopent-2-en-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.