5-Butyl-3-methoxy-2-cyclopenten-1-one
TL;DR: 5-Butyl-3-methoxy-2-cyclopenten-1-one (CAS 53690-89-4) is a chemical compound with molecular formula C10H16O2 and molecular weight 168.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-butyl-3-methoxycyclopent-2-en-1-one
Also Known As: 5-Butyl-3-methoxy-2-cyclopenten-1-one, 5-butyl-3-methoxycyclopent-2-en-1-one, 5-butyl-3-methoxycyclopent-2-enone, 2-Cyclopenten-1-one, 5-butyl-3-methoxy-, 5-Butyl-3-methoxy-2-cyclopenten-1-one #
| Molecular Formula | C10H16O2 |
|---|---|
| Molecular Weight | 168.12 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 168.11504 |
| Heavy Atoms | 12 |
| Complexity | 194.0 |
Chemical Identifiers
| CAS Number | 53690-89-4 |
|---|---|
| SMILES | CCCCC1CC(=CC1=O)OC |
| InChIKey | CONTYKWBFDNXFF-UHFFFAOYSA-N |
Product Overview
5-Butyl-3-methoxy-2-cyclopenten-1-one (CAS 53690-89-4), with molecular formula C10H16O2 and molecular weight 168.12 g/mol. IUPAC: 5-butyl-3-methoxycyclopent-2-en-1-one.
Chemical Property Profile of 5-Butyl-3-methoxy-2-cyclopenten-1-one
Property Insights of 5-Butyl-3-methoxy-2-cyclopenten-1-one
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Butyl-3-methoxy-2-cyclopenten-1-one. With a topological polar surface area (TPSA) of 26.3 Ų, 5-Butyl-3-methoxy-2-cyclopenten-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Butyl-3-methoxy-2-cyclopenten-1-one has 0 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-Butyl-3-methoxy-2-cyclopenten-1-one?
The CAS number of 5-Butyl-3-methoxy-2-cyclopenten-1-one is 53690-89-4.
What is the molecular formula of 5-Butyl-3-methoxy-2-cyclopenten-1-one?
The molecular formula of 5-Butyl-3-methoxy-2-cyclopenten-1-one is C10H16O2.
What is the molecular weight of 5-Butyl-3-methoxy-2-cyclopenten-1-one?
The molecular weight of 5-Butyl-3-methoxy-2-cyclopenten-1-one is 168.12 g/mol.
Where can I buy 5-Butyl-3-methoxy-2-cyclopenten-1-one?
You can request a quote for 5-Butyl-3-methoxy-2-cyclopenten-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-Butyl-3-methoxy-2-cyclopenten-1-one?
Yes, KEHONG BIO provides custom synthesis services for 5-Butyl-3-methoxy-2-cyclopenten-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.