2-Butyl-3-propyloxirane
TL;DR: 2-Butyl-3-propyloxirane (CAS 117842-34-9) is a chemical compound with molecular formula C9H18O and molecular weight 142.13577 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-butyl-3-propyloxirane
Also Known As: 2-Butyl-3-propyloxirane, trans-4,5-Epoxynonane, Oxirane, 2-butyl-3-propyl-, Oxirane, 2-butyl-3-propyl-, J1.669.425H
Application Areas
Top 5 of 4 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C9H18O |
| Molecular Weight | 142.13577 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 12.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 142.13577 Da |
| Heavy Atoms | 10 |
| Complexity | 90.0 |
| SMILES | CCCCC1C(O1)CCC |
| InChIKey | IKNXPNNMKVOEMV-UHFFFAOYSA-N |
Chemical Property Profile of 2-Butyl-3-propyloxirane
Property Insights of 2-Butyl-3-propyloxirane
The XLogP value of 3.0 indicates that 2-Butyl-3-propyloxirane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.5 Ų, 2-Butyl-3-propyloxirane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Butyl-3-propyloxirane has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-Butyl-3-propyloxirane?
The CAS number of 2-Butyl-3-propyloxirane is 117842-34-9.
What is the molecular formula of 2-Butyl-3-propyloxirane?
The molecular formula of 2-Butyl-3-propyloxirane is C9H18O.
What is the molecular weight of 2-Butyl-3-propyloxirane?
The molecular weight of 2-Butyl-3-propyloxirane is 142.13577 g/mol.
Where can I buy 2-Butyl-3-propyloxirane?
You can request a quote for 2-Butyl-3-propyloxirane directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Butyl-3-propyloxirane?
Yes, CoreyChem provides custom synthesis services for 2-Butyl-3-propyloxirane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.