((1,1-Dimethylpropoxy)methyl)oxirane
TL;DR: ((1,1-Dimethylpropoxy)methyl)oxirane (CAS 42426-06-2) is a chemical compound with molecular formula C8H16O2 and molecular weight 144.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-methylbutan-2-yloxymethyl)oxirane
Also Known As: ((1,1-Dimethylpropoxy)methyl)oxirane, ((1,1-Dimethylpropoxy)-methyl)oxirane, 2-(2-methylbutan-2-yloxymethyl)oxirane, 2-{[(2-methylbutan-2-yl)oxy]methyl}oxirane
| Molecular Formula | C8H16O2 |
|---|---|
| Molecular Weight | 144.12 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 21.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 144.11504 |
| Heavy Atoms | 10 |
| Complexity | 110.0 |
Chemical Identifiers
| CAS Number | 42426-06-2 |
|---|---|
| SMILES | CCC(C)(C)OCC1CO1 |
| InChIKey | MFASXWKINCTMCP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
((1,1-Dimethylpropoxy)methyl)oxirane (CAS 42426-06-2), with molecular formula C8H16O2 and molecular weight 144.12 g/mol. IUPAC: 2-(2-methylbutan-2-yloxymethyl)oxirane.
Chemical Property Profile of ((1,1-Dimethylpropoxy)methyl)oxirane
Property Insights of ((1,1-Dimethylpropoxy)methyl)oxirane
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ((1,1-Dimethylpropoxy)methyl)oxirane. With a topological polar surface area (TPSA) of 21.8 Ų, ((1,1-Dimethylpropoxy)methyl)oxirane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ((1,1-Dimethylpropoxy)methyl)oxirane 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 ((1,1-Dimethylpropoxy)methyl)oxirane?
The CAS number of ((1,1-Dimethylpropoxy)methyl)oxirane is 42426-06-2.
What is the molecular formula of ((1,1-Dimethylpropoxy)methyl)oxirane?
The molecular formula of ((1,1-Dimethylpropoxy)methyl)oxirane is C8H16O2.
What is the molecular weight of ((1,1-Dimethylpropoxy)methyl)oxirane?
The molecular weight of ((1,1-Dimethylpropoxy)methyl)oxirane is 144.12 g/mol.
Where can I buy ((1,1-Dimethylpropoxy)methyl)oxirane?
You can request a quote for ((1,1-Dimethylpropoxy)methyl)oxirane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ((1,1-Dimethylpropoxy)methyl)oxirane?
Yes, KEHONG BIO provides custom synthesis services for ((1,1-Dimethylpropoxy)methyl)oxirane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.