4-tert-Butylcyclohexylidene oxide
TL;DR: 4-tert-Butylcyclohexylidene oxide (CAS 33876-24-3) is a chemical compound with molecular formula C11H20O and molecular weight 168.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-tert-butyl-1-oxaspiro[2.5]octane
Also Known As: 6-tert-Butyl-1-oxaspiro[2.5]octane, 4-tert-Butylcyclohexylidene oxide, 6-tert-butyl-2-oxaspiro[2.5]octane, 3-tert-Butyl-7-oxaspiro[5.2]octane, 6-(tert-butyl)-1-oxaspiro[2.5]octane
| Molecular Formula | C11H20O |
|---|---|
| Molecular Weight | 168.15 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 12.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 168.15141 |
| Heavy Atoms | 12 |
| Complexity | 170.0 |
Chemical Identifiers
| CAS Number | 33876-24-3 |
|---|---|
| SMILES | CC(C)(C)C1CCC2(CC1)CO2 |
| InChIKey | MTVKBMPEWYZOIM-UHFFFAOYSA-N |
Product Overview
4-tert-Butylcyclohexylidene oxide (CAS 33876-24-3), with molecular formula C11H20O and molecular weight 168.15 g/mol. IUPAC: 6-tert-butyl-1-oxaspiro[2.5]octane.
Chemical Property Profile of 4-tert-Butylcyclohexylidene oxide
Property Insights of 4-tert-Butylcyclohexylidene oxide
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-tert-Butylcyclohexylidene oxide. With a topological polar surface area (TPSA) of 12.5 Ų, 4-tert-Butylcyclohexylidene oxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-tert-Butylcyclohexylidene oxide 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 4-tert-Butylcyclohexylidene oxide?
The CAS number of 4-tert-Butylcyclohexylidene oxide is 33876-24-3.
What is the molecular formula of 4-tert-Butylcyclohexylidene oxide?
The molecular formula of 4-tert-Butylcyclohexylidene oxide is C11H20O.
What is the molecular weight of 4-tert-Butylcyclohexylidene oxide?
The molecular weight of 4-tert-Butylcyclohexylidene oxide is 168.15 g/mol.
Where can I buy 4-tert-Butylcyclohexylidene oxide?
You can request a quote for 4-tert-Butylcyclohexylidene oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-tert-Butylcyclohexylidene oxide?
Yes, KEHONG BIO provides custom synthesis services for 4-tert-Butylcyclohexylidene oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.