trans-2,3-Dimethyloxirane
TL;DR: trans-2,3-Dimethyloxirane (CAS 21490-63-1) is a chemical compound with molecular formula C4H8O and molecular weight 72.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,3S)-2,3-dimethyloxirane
Also Known As: trans-2,3-Epoxybutane, (2S,3S)-2,3-dimethyloxirane, beta-Oxybutene, trans-2-Butene oxide, trans-2,3-Dimethyloxirane
| Molecular Formula | C4H8O |
|---|---|
| Molecular Weight | 72.06 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 12.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 72.05752 |
| Heavy Atoms | 5 |
| Complexity | 36.0 |
Chemical Identifiers
| CAS Number | 21490-63-1 |
|---|---|
| SMILES | C[C@H]1[C@@H](O1)C |
| InChIKey | PQXKWPLDPFFDJP-IMJSIDKUSA-N |
Patent-Derived Application Labels
Derived from 17 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
trans-2,3-Dimethyloxirane (CAS 21490-63-1), with molecular formula C4H8O and molecular weight 72.06 g/mol. IUPAC: (2S,3S)-2,3-dimethyloxirane.
Chemical Property Profile of trans-2,3-Dimethyloxirane
Property Insights of trans-2,3-Dimethyloxirane
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for trans-2,3-Dimethyloxirane. With a topological polar surface area (TPSA) of 12.5 Ų, trans-2,3-Dimethyloxirane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, trans-2,3-Dimethyloxirane 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 trans-2,3-Dimethyloxirane?
The CAS number of trans-2,3-Dimethyloxirane is 21490-63-1.
What is the molecular formula of trans-2,3-Dimethyloxirane?
The molecular formula of trans-2,3-Dimethyloxirane is C4H8O.
What is the molecular weight of trans-2,3-Dimethyloxirane?
The molecular weight of trans-2,3-Dimethyloxirane is 72.06 g/mol.
Where can I buy trans-2,3-Dimethyloxirane?
You can request a quote for trans-2,3-Dimethyloxirane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for trans-2,3-Dimethyloxirane?
Yes, KEHONG BIO provides custom synthesis services for trans-2,3-Dimethyloxirane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.