2-(3-Bromophenyl)oxirane
TL;DR: 2-(3-Bromophenyl)oxirane (CAS 131567-05-0) is a chemical compound with molecular formula C8H7BrO and molecular weight 197.96803 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(3-bromophenyl)oxirane
Also Known As: 2-(3-bromophenyl)oxirane, Oxirane, 2-(3-bromophenyl)-, 3-bromostyrene oxide, Oxirane, (3-bromophenyl)-, 3-Bromostyreneoxide
Application Areas
Top 5 of 4 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C8H7BrO |
| Molecular Weight | 197.96803 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 12.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 197.96803 Da |
| Heavy Atoms | 10 |
| Complexity | 126.0 |
| SMILES | C1C(O1)C2=CC(=CC=C2)Br |
| InChIKey | YUPLJNGZNHMXGM-UHFFFAOYSA-N |
Chemical Property Profile of 2-(3-Bromophenyl)oxirane
Property Insights of 2-(3-Bromophenyl)oxirane
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(3-Bromophenyl)oxirane. With a topological polar surface area (TPSA) of 12.5 Ų, 2-(3-Bromophenyl)oxirane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(3-Bromophenyl)oxirane 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-(3-Bromophenyl)oxirane?
The CAS number of 2-(3-Bromophenyl)oxirane is 131567-05-0.
What is the molecular formula of 2-(3-Bromophenyl)oxirane?
The molecular formula of 2-(3-Bromophenyl)oxirane is C8H7BrO.
What is the molecular weight of 2-(3-Bromophenyl)oxirane?
The molecular weight of 2-(3-Bromophenyl)oxirane is 197.96803 g/mol.
Where can I buy 2-(3-Bromophenyl)oxirane?
You can request a quote for 2-(3-Bromophenyl)oxirane directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(3-Bromophenyl)oxirane?
Yes, CoreyChem provides custom synthesis services for 2-(3-Bromophenyl)oxirane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.