1-Ethoxybut-1-ene
TL;DR: 1-Ethoxybut-1-ene (CAS 1528-20-7) is a chemical compound with molecular formula C6H12O and molecular weight 100.08881 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-ethoxybut-1-ene
Also Known As: 1-ethoxybut-1-ene, 1-Butene, 1-ethoxy-, ethyl butenyl ether, 1-ethoxybut-1-en, 1-Ethoxy-1-butene
Application Areas
Top 5 of 9 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C6H12O |
| Molecular Weight | 100.08881 g/mol |
| XLogP | 1.9 |
| Topological Polar Surface Area (TPSA) | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 100.08881 Da |
| Heavy Atoms | 7 |
| Complexity | 48.0 |
| SMILES | CCC=COCC |
| InChIKey | AQTYNINXYJFSHD-UHFFFAOYSA-N |
Chemical Property Profile of 1-Ethoxybut-1-ene
Property Insights of 1-Ethoxybut-1-ene
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Ethoxybut-1-ene. With a topological polar surface area (TPSA) of 9.2 Ų, 1-Ethoxybut-1-ene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Ethoxybut-1-ene 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 1-Ethoxybut-1-ene?
The CAS number of 1-Ethoxybut-1-ene is 1528-20-7.
What is the molecular formula of 1-Ethoxybut-1-ene?
The molecular formula of 1-Ethoxybut-1-ene is C6H12O.
What is the molecular weight of 1-Ethoxybut-1-ene?
The molecular weight of 1-Ethoxybut-1-ene is 100.08881 g/mol.
Where can I buy 1-Ethoxybut-1-ene?
You can request a quote for 1-Ethoxybut-1-ene directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-Ethoxybut-1-ene?
Yes, CoreyChem provides custom synthesis services for 1-Ethoxybut-1-ene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.