Ethyl-i-pentenylether
TL;DR: Ethyl-i-pentenylether (CAS 30989-66-3) is a chemical compound with molecular formula C7H14O and molecular weight 114.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-ethoxy-3-methylbut-1-ene
Also Known As: Ethyl-i-pentenylether, 1-ethoxy-3-methylbut-1-ene, 1-ethoxy-3-methyl-but-1-ene, (1E)-1-ethoxy-3-methylbut-1-ene, (E)-1-ethoxy-3-methylbut-1-ene
| Molecular Formula | C7H14O |
|---|---|
| Molecular Weight | 114.10 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 114.10446 |
| Heavy Atoms | 8 |
| Complexity | 64.0 |
Chemical Identifiers
| CAS Number | 30989-66-3 |
|---|---|
| SMILES | CCOC=CC(C)C |
| InChIKey | KLKHJTPIDMZMBB-UHFFFAOYSA-N |
Product Overview
Ethyl-i-pentenylether (CAS 30989-66-3), with molecular formula C7H14O and molecular weight 114.10 g/mol. IUPAC: 1-ethoxy-3-methylbut-1-ene.
Chemical Property Profile of Ethyl-i-pentenylether
Property Insights of Ethyl-i-pentenylether
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl-i-pentenylether. With a topological polar surface area (TPSA) of 9.2 Ų, Ethyl-i-pentenylether exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl-i-pentenylether 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
Frequently Asked Questions
What is the CAS number of Ethyl-i-pentenylether?
The CAS number of Ethyl-i-pentenylether is 30989-66-3.
What is the molecular formula of Ethyl-i-pentenylether?
The molecular formula of Ethyl-i-pentenylether is C7H14O.
What is the molecular weight of Ethyl-i-pentenylether?
The molecular weight of Ethyl-i-pentenylether is 114.10 g/mol.
Where can I buy Ethyl-i-pentenylether?
You can request a quote for Ethyl-i-pentenylether directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl-i-pentenylether?
Yes, KEHONG BIO provides custom synthesis services for Ethyl-i-pentenylether and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.