1-(4'-Ethylphenoxy)-6,7-epoxy-3,7-dimethyl-2-octene
TL;DR: 1-(4'-Ethylphenoxy)-6,7-epoxy-3,7-dimethyl-2-octene (CAS 37571-83-8) is a chemical compound with molecular formula C18H26O2 and molecular weight 274.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[5-(4-ethylphenoxy)-3-methylpent-3-enyl]-2,2-dimethyloxirane
Also Known As: ethylphenylepoxygeranylether, 1-(4'-Ethylphenoxy)-6,7-epoxy-3,7-dimethyl-2-octene, 3-[5-(4-ethylphenoxy)-3-methylpent-3-enyl]-2,2-dimethyloxirane
| Molecular Formula | C18H26O2 |
|---|---|
| Molecular Weight | 274.19 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 21.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 274.19327 |
| Heavy Atoms | 20 |
| Complexity | 324.0 |
Chemical Identifiers
| CAS Number | 37571-83-8 |
|---|---|
| SMILES | CCC1=CC=C(C=C1)OCC=C(C)CCC2C(O2)(C)C |
| InChIKey | VBRBNWWNRIMAII-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(4'-Ethylphenoxy)-6,7-epoxy-3,7-dimethyl-2-octene (CAS 37571-83-8), with molecular formula C18H26O2 and molecular weight 274.19 g/mol. IUPAC: 3-[5-(4-ethylphenoxy)-3-methylpent-3-enyl]-2,2-dimethyloxirane.
Chemical Property Profile of 1-(4'-Ethylphenoxy)-6,7-epoxy-3,7-dimethyl-2-octene
Property Insights of 1-(4'-Ethylphenoxy)-6,7-epoxy-3,7-dimethyl-2-octene
The XLogP value of 4.8 indicates that 1-(4'-Ethylphenoxy)-6,7-epoxy-3,7-dimethyl-2-octene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 21.8 Ų, 1-(4'-Ethylphenoxy)-6,7-epoxy-3,7-dimethyl-2-octene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4'-Ethylphenoxy)-6,7-epoxy-3,7-dimethyl-2-octene has 0 hydrogen bond donor(s) and 2 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 1-(4'-Ethylphenoxy)-6,7-epoxy-3,7-dimethyl-2-octene?
The CAS number of 1-(4'-Ethylphenoxy)-6,7-epoxy-3,7-dimethyl-2-octene is 37571-83-8.
What is the molecular formula of 1-(4'-Ethylphenoxy)-6,7-epoxy-3,7-dimethyl-2-octene?
The molecular formula of 1-(4'-Ethylphenoxy)-6,7-epoxy-3,7-dimethyl-2-octene is C18H26O2.
What is the molecular weight of 1-(4'-Ethylphenoxy)-6,7-epoxy-3,7-dimethyl-2-octene?
The molecular weight of 1-(4'-Ethylphenoxy)-6,7-epoxy-3,7-dimethyl-2-octene is 274.19 g/mol.
Where can I buy 1-(4'-Ethylphenoxy)-6,7-epoxy-3,7-dimethyl-2-octene?
You can request a quote for 1-(4'-Ethylphenoxy)-6,7-epoxy-3,7-dimethyl-2-octene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4'-Ethylphenoxy)-6,7-epoxy-3,7-dimethyl-2-octene?
Yes, KEHONG BIO provides custom synthesis services for 1-(4'-Ethylphenoxy)-6,7-epoxy-3,7-dimethyl-2-octene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.