S-Bioallethrin
TL;DR: S-Bioallethrin (CAS 28434-00-6) is a chemical compound with molecular formula C19H26O3 and molecular weight 302.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
cis-[(1S)-2-methyl-4-oxo-3-prop-2-enylcyclopent-2-en-1-yl] (1R,3R)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate
Also Known As: S-BIOALLETHRIN, Esbiol, Esbioallethrin, Esdepallethrine, Bioallethrin
| Molecular Formula | C19H26O3 |
|---|---|
| Molecular Weight | 302.19 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 302.1882 |
| Heavy Atoms | 22 |
| Complexity | 573.0 |
| Density | Relative density (water = 1): 0.98 |
| Solubility | Solubility in water: none |
| Flash Point | ~120 °C |
Chemical Identifiers
| CAS Number | 28434-00-6 |
|---|---|
| SMILES | CC1=C(C(=O)C[C@@H]1OC(=O)[C@@H]2[C@H](C2(C)C)C=C(C)C)CC=C |
| InChIKey | ZCVAOQKBXKSDMS-PVAVHDDUSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
S-Bioallethrin (CAS 28434-00-6), with molecular formula C19H26O3 and molecular weight 302.19 g/mol. IUPAC: cis-[(1S)-2-methyl-4-oxo-3-prop-2-enylcyclopent-2-en-1-yl] (1R,3R)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate.
Chemical Property Profile of S-Bioallethrin
Property Insights of S-Bioallethrin
The XLogP value of 4.8 indicates that S-Bioallethrin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.4 Ų, S-Bioallethrin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, S-Bioallethrin 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 S-Bioallethrin?
The CAS number of S-Bioallethrin is 28434-00-6.
What is the molecular formula of S-Bioallethrin?
The molecular formula of S-Bioallethrin is C19H26O3.
What is the molecular weight of S-Bioallethrin?
The molecular weight of S-Bioallethrin is 302.19 g/mol.
Where can I buy S-Bioallethrin?
You can request a quote for S-Bioallethrin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for S-Bioallethrin?
Yes, KEHONG BIO provides custom synthesis services for S-Bioallethrin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.