2-Methyl-2-(4-nitrophenyl)oxirane
TL;DR: 2-Methyl-2-(4-nitrophenyl)oxirane (CAS 75590-19-1) is a chemical compound with molecular formula C9H9NO3 and molecular weight 179.05824 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-methyl-2-(4-nitrophenyl)oxirane
Also Known As: 2-Methyl-2-(4-nitrophenyl)oxirane, Oxirane, 2-methyl-2-(4-nitrophenyl)-, 2-Methyl-2-(4-nitrophenyl)oxirane, (+/-)-, (+/-)-2-methyl-2-(4-nitrophenyl)oxirane, 2-METHYL-2-(4-NITROPHENYL)OXIRANE, (RS)-
Technical Specifications
| Molecular Formula | C9H9NO3 |
| Molecular Weight | 179.05824 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 58.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 179.05824 Da |
| Heavy Atoms | 13 |
| Complexity | 217.0 |
| SMILES | CC1(CO1)C2=CC=C(C=C2)[N+](=O)[O-] |
| InChIKey | BHJABURPYYGBAY-UHFFFAOYSA-N |
Chemical Property Profile of 2-Methyl-2-(4-nitrophenyl)oxirane
Property Insights of 2-Methyl-2-(4-nitrophenyl)oxirane
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methyl-2-(4-nitrophenyl)oxirane. With a topological polar surface area (TPSA) of 58.4 Ų, 2-Methyl-2-(4-nitrophenyl)oxirane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methyl-2-(4-nitrophenyl)oxirane has 0 hydrogen bond donor(s) and 3 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-Methyl-2-(4-nitrophenyl)oxirane?
The CAS number of 2-Methyl-2-(4-nitrophenyl)oxirane is 75590-19-1.
What is the molecular formula of 2-Methyl-2-(4-nitrophenyl)oxirane?
The molecular formula of 2-Methyl-2-(4-nitrophenyl)oxirane is C9H9NO3.
What is the molecular weight of 2-Methyl-2-(4-nitrophenyl)oxirane?
The molecular weight of 2-Methyl-2-(4-nitrophenyl)oxirane is 179.05824 g/mol.
Where can I buy 2-Methyl-2-(4-nitrophenyl)oxirane?
You can request a quote for 2-Methyl-2-(4-nitrophenyl)oxirane directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Methyl-2-(4-nitrophenyl)oxirane?
Yes, CoreyChem provides custom synthesis services for 2-Methyl-2-(4-nitrophenyl)oxirane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.