Ether, tert-butyl 1-cyclohexen-1-yl
TL;DR: Ether, tert-butyl 1-cyclohexen-1-yl (CAS 31053-82-4) is a chemical compound with molecular formula C10H18O and molecular weight 154.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(2-methylpropan-2-yl)oxy]cyclohexene
Also Known As: 1-tert-Butoxycyclohexene, 1-(tert-butoxy)cyclohex-1-ene, 1-tert-Butoxy-1-cyclohexene, Ether, tert-butyl 1-cyclohexen-1-yl, Cyclohexene, 1-(1,1-dimethylethoxy)-
| Molecular Formula | C10H18O |
|---|---|
| Molecular Weight | 154.14 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 154.13577 |
| Heavy Atoms | 11 |
| Complexity | 151.0 |
Chemical Identifiers
| CAS Number | 31053-82-4 |
|---|---|
| SMILES | CC(C)(C)OC1=CCCCC1 |
| InChIKey | LYKXVMWCTKYYIF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ether, tert-butyl 1-cyclohexen-1-yl (CAS 31053-82-4), with molecular formula C10H18O and molecular weight 154.14 g/mol. IUPAC: 1-[(2-methylpropan-2-yl)oxy]cyclohexene.
Chemical Property Profile of Ether, tert-butyl 1-cyclohexen-1-yl
Property Insights of Ether, tert-butyl 1-cyclohexen-1-yl
The XLogP value of 3.0 indicates that Ether, tert-butyl 1-cyclohexen-1-yl is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.2 Ų, Ether, tert-butyl 1-cyclohexen-1-yl exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ether, tert-butyl 1-cyclohexen-1-yl 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 Ether, tert-butyl 1-cyclohexen-1-yl?
The CAS number of Ether, tert-butyl 1-cyclohexen-1-yl is 31053-82-4.
What is the molecular formula of Ether, tert-butyl 1-cyclohexen-1-yl?
The molecular formula of Ether, tert-butyl 1-cyclohexen-1-yl is C10H18O.
What is the molecular weight of Ether, tert-butyl 1-cyclohexen-1-yl?
The molecular weight of Ether, tert-butyl 1-cyclohexen-1-yl is 154.14 g/mol.
Where can I buy Ether, tert-butyl 1-cyclohexen-1-yl?
You can request a quote for Ether, tert-butyl 1-cyclohexen-1-yl directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ether, tert-butyl 1-cyclohexen-1-yl?
Yes, KEHONG BIO provides custom synthesis services for Ether, tert-butyl 1-cyclohexen-1-yl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.