Trimethyloxirane
TL;DR: Trimethyloxirane (CAS 5076-19-7) is a chemical compound with molecular formula C5H10O and molecular weight 86.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2,3-trimethyloxirane
Also Known As: 2,2,3-Trimethyloxirane, Oxirane, trimethyl-, 2,3-Epoxy-2-methylbutane, Isoamylene oxide, TRIMETHYLOXIRANE
| Molecular Formula | C5H10O |
|---|---|
| Molecular Weight | 86.07 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 12.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 86.073166 |
| Heavy Atoms | 6 |
| Complexity | 66.0 |
Chemical Identifiers
| CAS Number | 5076-19-7 |
|---|---|
| SMILES | CC1C(O1)(C)C |
| InChIKey | QPBYBLZYMNWGMO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 16 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Trimethyloxirane (CAS 5076-19-7), with molecular formula C5H10O and molecular weight 86.07 g/mol. IUPAC: 2,2,3-trimethyloxirane.
Chemical Property Profile of Trimethyloxirane
Property Insights of Trimethyloxirane
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Trimethyloxirane. With a topological polar surface area (TPSA) of 12.5 Ų, Trimethyloxirane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Trimethyloxirane 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 Trimethyloxirane?
The CAS number of Trimethyloxirane is 5076-19-7.
What is the molecular formula of Trimethyloxirane?
The molecular formula of Trimethyloxirane is C5H10O.
What is the molecular weight of Trimethyloxirane?
The molecular weight of Trimethyloxirane is 86.07 g/mol.
Where can I buy Trimethyloxirane?
You can request a quote for Trimethyloxirane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Trimethyloxirane?
Yes, KEHONG BIO provides custom synthesis services for Trimethyloxirane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.