4-Methyl-2-(1-methylethyl)-1,3-dioxolane
TL;DR: 4-Methyl-2-(1-methylethyl)-1,3-dioxolane (CAS 67879-60-1) is a chemical compound with molecular formula C7H14O2 and molecular weight 130.09938 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-methyl-2-propan-2-yl-1,3-dioxolane
Also Known As: 2-Isopropyl-4-methyl-1,3-dioxolane, 4-methyl-2-(propan-2-yl)-1,3-dioxolane, Isobutyraldehyde, propylene glycol acetal, 4-methyl-2-propan-2-yl-1,3-dioxolane, C(C)(C)C1OCC(C)O1
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C7H14O2 |
| Molecular Weight | 130.09938 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 130.09938 Da |
| Heavy Atoms | 9 |
| Complexity | 90.0 |
| Density | 0.903-0.909 |
| Refractive Index | 1.407-1.412 |
| Solubility | Insoluble in water; soluble in organic solvents |
| SMILES | CC1COC(O1)C(C)C |
| InChIKey | NWXXKKDLGZLEGH-UHFFFAOYSA-N |
Chemical Property Profile of 4-Methyl-2-(1-methylethyl)-1,3-dioxolane
Property Insights of 4-Methyl-2-(1-methylethyl)-1,3-dioxolane
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Methyl-2-(1-methylethyl)-1,3-dioxolane. With a topological polar surface area (TPSA) of 18.5 Ų, 4-Methyl-2-(1-methylethyl)-1,3-dioxolane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Methyl-2-(1-methylethyl)-1,3-dioxolane 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
What is the CAS number of 4-Methyl-2-(1-methylethyl)-1,3-dioxolane?
The CAS number of 4-Methyl-2-(1-methylethyl)-1,3-dioxolane is 67879-60-1.
What is the molecular formula of 4-Methyl-2-(1-methylethyl)-1,3-dioxolane?
The molecular formula of 4-Methyl-2-(1-methylethyl)-1,3-dioxolane is C7H14O2.
What is the molecular weight of 4-Methyl-2-(1-methylethyl)-1,3-dioxolane?
The molecular weight of 4-Methyl-2-(1-methylethyl)-1,3-dioxolane is 130.09938 g/mol.
Where can I buy 4-Methyl-2-(1-methylethyl)-1,3-dioxolane?
You can request a quote for 4-Methyl-2-(1-methylethyl)-1,3-dioxolane directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-Methyl-2-(1-methylethyl)-1,3-dioxolane?
Yes, CoreyChem provides custom synthesis services for 4-Methyl-2-(1-methylethyl)-1,3-dioxolane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.