2-(4-Bromophenyl)-2-methyloxirane
TL;DR: 2-(4-Bromophenyl)-2-methyloxirane (CAS 80909-78-0) is a chemical compound with molecular formula C9H9BrO and molecular weight 211.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-bromophenyl)-2-methyloxirane
Also Known As: 2-(4-Bromophenyl)-2-methyloxirane, Oxirane, 2-(4-bromophenyl)-2-methyl-, p-bromo-alpha-methyl styrene oxide, 2-(4-Bromo-phenyl)-2-methyl-oxirane, 2-Methyl-2-(4-bromophenyl)oxirane
| Molecular Formula | C9H9BrO |
|---|---|
| Molecular Weight | 211.98 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 12.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 211.98367 |
| Heavy Atoms | 11 |
| Complexity | 152.0 |
Chemical Identifiers
| CAS Number | 80909-78-0 |
|---|---|
| SMILES | CC1(CO1)C2=CC=C(C=C2)Br |
| InChIKey | HQVFPGVGWGVIMU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(4-Bromophenyl)-2-methyloxirane (CAS 80909-78-0), with molecular formula C9H9BrO and molecular weight 211.98 g/mol. IUPAC: 2-(4-bromophenyl)-2-methyloxirane.
Chemical Property Profile of 2-(4-Bromophenyl)-2-methyloxirane
Property Insights of 2-(4-Bromophenyl)-2-methyloxirane
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-Bromophenyl)-2-methyloxirane. With a topological polar surface area (TPSA) of 12.5 Ų, 2-(4-Bromophenyl)-2-methyloxirane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Bromophenyl)-2-methyloxirane 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 2-(4-Bromophenyl)-2-methyloxirane?
The CAS number of 2-(4-Bromophenyl)-2-methyloxirane is 80909-78-0.
What is the molecular formula of 2-(4-Bromophenyl)-2-methyloxirane?
The molecular formula of 2-(4-Bromophenyl)-2-methyloxirane is C9H9BrO.
What is the molecular weight of 2-(4-Bromophenyl)-2-methyloxirane?
The molecular weight of 2-(4-Bromophenyl)-2-methyloxirane is 211.98 g/mol.
Where can I buy 2-(4-Bromophenyl)-2-methyloxirane?
You can request a quote for 2-(4-Bromophenyl)-2-methyloxirane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Bromophenyl)-2-methyloxirane?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Bromophenyl)-2-methyloxirane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.