2,2-Dimethyl-3-phenyloxirane
TL;DR: 2,2-Dimethyl-3-phenyloxirane (CAS 130365-53-6) is a chemical compound with molecular formula C10H12O and molecular weight 148.08882 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,2-dimethyl-3-phenyloxirane
Also Known As: 2,2-Dimethyl-3-phenyloxirane, Methylthioacetylene, dimethylphenyloxirane, (-)-Chinyldiacetat, Oxirane, 2,2-dimethyl-3-phenyl-
Technical Specifications
| Molecular Formula | C10H12O |
| Molecular Weight | 148.08882 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 12.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 148.08882 Da |
| Heavy Atoms | 11 |
| Complexity | 145.0 |
| SMILES | CC1(C(O1)C2=CC=CC=C2)C |
| InChIKey | GIMKHGWDFQQNSB-UHFFFAOYSA-N |
Chemical Property Profile of 2,2-Dimethyl-3-phenyloxirane
Property Insights of 2,2-Dimethyl-3-phenyloxirane
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,2-Dimethyl-3-phenyloxirane. With a topological polar surface area (TPSA) of 12.5 Ų, 2,2-Dimethyl-3-phenyloxirane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2-Dimethyl-3-phenyloxirane 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 2,2-Dimethyl-3-phenyloxirane?
The CAS number of 2,2-Dimethyl-3-phenyloxirane is 130365-53-6.
What is the molecular formula of 2,2-Dimethyl-3-phenyloxirane?
The molecular formula of 2,2-Dimethyl-3-phenyloxirane is C10H12O.
What is the molecular weight of 2,2-Dimethyl-3-phenyloxirane?
The molecular weight of 2,2-Dimethyl-3-phenyloxirane is 148.08882 g/mol.
Where can I buy 2,2-Dimethyl-3-phenyloxirane?
You can request a quote for 2,2-Dimethyl-3-phenyloxirane directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2,2-Dimethyl-3-phenyloxirane?
Yes, CoreyChem provides custom synthesis services for 2,2-Dimethyl-3-phenyloxirane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.