Isobutylene oxide
TL;DR: Isobutylene oxide (CAS 558-30-5) is a chemical compound with molecular formula C4H8O and molecular weight 72.05752 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,2-dimethyloxirane
Also Known As: Isobutylene oxide, 2,2-DIMETHYLOXIRANE, Isobutene oxide, Isobutyleneoxide, Isobutylene epoxide
Application Areas
Top 5 of 22 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C4H8O |
| Molecular Weight | 72.05752 g/mol |
| XLogP | 0.5 |
| Topological Polar Surface Area (TPSA) | 12.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 72.05752 Da |
| Heavy Atoms | 5 |
| Complexity | 47.0 |
| Vapor Pressure | 387.0 [mmHg] |
| Solubility | 58 mg/mL at 20 °C |
| SMILES | CC1(CO1)C |
| InChIKey | GELKGHVAFRCJNA-UHFFFAOYSA-N |
Product Description
Applications: Isobutylene oxide is used in polymer chemistry and functional materials synthesis, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as an oxidizing agent in synthetic sequences. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
Isobutylene oxide (CAS 558-30-5) is a polymer intermediate with the molecular formula C4H8O and a molecular weight of 72.06 g/mol. Key physical properties include a solubility: 58 mg/mL at 20 °C. Synonyms include Isobutylene oxide and 2,2-DIMETHYLOXIRANE.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of Isobutylene oxide
Property Insights of Isobutylene oxide
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Isobutylene oxide. With a topological polar surface area (TPSA) of 12.5 Ų, Isobutylene oxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isobutylene 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
What is the CAS number of Isobutylene oxide?
The CAS number of Isobutylene oxide is 558-30-5.
What is the molecular formula of Isobutylene oxide?
The molecular formula of Isobutylene oxide is C4H8O.
What is the molecular weight of Isobutylene oxide?
The molecular weight of Isobutylene oxide is 72.05752 g/mol.
What are the applications of Isobutylene oxide?
Isobutylene oxide is used in polymer chemistry and functional materials synthesis, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as an oxidizing agent in synthetic sequences. Available from CoreyChem as both catalog item and...
Where can I buy Isobutylene oxide?
You can request a quote for Isobutylene oxide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Isobutylene oxide?
Yes, CoreyChem provides custom synthesis services for Isobutylene oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.