cis-1-Propenyl isobutyl ether
TL;DR: cis-1-Propenyl isobutyl ether (CAS 16958-99-9) 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.
2-methyl-1-[(Z)-prop-1-enoxy]propane
Also Known As: cis-1-Propenyl isobutyl ether, 2-methyl-1-[(Z)-prop-1-enoxy]propane
| Molecular Formula | C7H14O |
|---|---|
| Molecular Weight | 114.10 g/mol |
| LogP | 2.1926 |
| Topological Polar Surface Area | 9.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 114.10446 |
| Heavy Atoms | 8 |
| Complexity | 64.78708 |
Chemical Identifiers
| CAS Number | 16958-99-9 |
|---|---|
| SMILES | C/C=C\OCC(C)C |
Product Overview
cis-1-Propenyl isobutyl ether (CAS 16958-99-9), with molecular formula C7H14O and molecular weight 114.10 g/mol. IUPAC: 2-methyl-1-[(Z)-prop-1-enoxy]propane.
Chemical Property Profile of cis-1-Propenyl isobutyl ether
Property Insights of cis-1-Propenyl isobutyl ether
The XLogP value of 2.1926 suggests moderate lipophilicity, balancing water solubility and membrane permeability for cis-1-Propenyl isobutyl ether. With a topological polar surface area (TPSA) of 9.23 Ų, cis-1-Propenyl isobutyl ether exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, cis-1-Propenyl isobutyl ether 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 cis-1-Propenyl isobutyl ether?
The CAS number of cis-1-Propenyl isobutyl ether is 16958-99-9.
What is the molecular formula of cis-1-Propenyl isobutyl ether?
The molecular formula of cis-1-Propenyl isobutyl ether is C7H14O.
What is the molecular weight of cis-1-Propenyl isobutyl ether?
The molecular weight of cis-1-Propenyl isobutyl ether is 114.10 g/mol.
Where can I buy cis-1-Propenyl isobutyl ether?
You can request a quote for cis-1-Propenyl isobutyl ether directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for cis-1-Propenyl isobutyl ether?
Yes, KEHONG BIO provides custom synthesis services for cis-1-Propenyl isobutyl ether and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.