Cyclotene butyrate
TL;DR: Cyclotene butyrate (CAS 68227-51-0) is a chemical compound with molecular formula C10H14O3 and molecular weight 182.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-methyl-5-oxocyclopenten-1-yl) butanoate
Also Known As: Cyclotene butyrate, 2-methyl-5-oxocyclopent-1-en-1-yl butyrate, 2-Methyl-5-oxo-1-cyclopenten-1-yl butyrate, FEMA NO. 4648, 2-Methyl-5-oxo-1-cyclopentenyl Butyrate
| Molecular Formula | C10H14O3 |
|---|---|
| Molecular Weight | 182.09 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 182.0943 |
| Heavy Atoms | 13 |
| Complexity | 263.0 |
| Density | 1.063-1.069 (20°) |
| Solubility | Practically insoluble or insoluble in water; soluble in fats and oils |
| Refractive Index | 1.476-1.482 |
Chemical Identifiers
| CAS Number | 68227-51-0 |
|---|---|
| SMILES | CCCC(=O)OC1=C(CCC1=O)C |
| InChIKey | SUJWBOKDKMEAOQ-UHFFFAOYSA-N |
Product Overview
Cyclotene butyrate (CAS 68227-51-0), with molecular formula C10H14O3 and molecular weight 182.09 g/mol. IUPAC: (2-methyl-5-oxocyclopenten-1-yl) butanoate.
Chemical Property Profile of Cyclotene butyrate
Property Insights of Cyclotene butyrate
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cyclotene butyrate. With a topological polar surface area (TPSA) of 43.4 Ų, Cyclotene butyrate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cyclotene butyrate has 0 hydrogen bond donor(s) and 3 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 Cyclotene butyrate?
The CAS number of Cyclotene butyrate is 68227-51-0.
What is the molecular formula of Cyclotene butyrate?
The molecular formula of Cyclotene butyrate is C10H14O3.
What is the molecular weight of Cyclotene butyrate?
The molecular weight of Cyclotene butyrate is 182.09 g/mol.
Where can I buy Cyclotene butyrate?
You can request a quote for Cyclotene butyrate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cyclotene butyrate?
Yes, KEHONG BIO provides custom synthesis services for Cyclotene butyrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.