2-(2-Bromophenyl)cyclohexa-2,5-diene-1,4-dione
TL;DR: 2-(2-Bromophenyl)cyclohexa-2,5-diene-1,4-dione (CAS 100125-64-2) is a chemical compound with molecular formula C12H7BrO2 and molecular weight 261.96295 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(2-bromophenyl)cyclohexa-2,5-diene-1,4-dione
Also Known As: 2-(2-bromophenyl)-1,4-benzoquinone, 2 -Bromobiphenyl-2,5-dione, 2-(2-bromophenyl)cyclohexa-2,5-diene-1,4-dione, (2-bromo-phenyl)-[1,4]benzoquinone, 2'-bromo-[1,1'-biphenyl]-2,5-dione
Technical Specifications
| Molecular Formula | C12H7BrO2 |
| Molecular Weight | 261.96295 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 34.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 261.96295 Da |
| Heavy Atoms | 15 |
| Complexity | 355.0 |
| SMILES | C1=CC=C(C(=C1)C2=CC(=O)C=CC2=O)Br |
| InChIKey | GAAMRZOOFCKTTG-UHFFFAOYSA-N |
Chemical Property Profile of 2-(2-Bromophenyl)cyclohexa-2,5-diene-1,4-dione
Property Insights of 2-(2-Bromophenyl)cyclohexa-2,5-diene-1,4-dione
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2-Bromophenyl)cyclohexa-2,5-diene-1,4-dione. With a topological polar surface area (TPSA) of 34.1 Ų, 2-(2-Bromophenyl)cyclohexa-2,5-diene-1,4-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2-Bromophenyl)cyclohexa-2,5-diene-1,4-dione has 0 hydrogen bond donor(s) and 2 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-Bromophenyl)cyclohexa-2,5-diene-1,4-dione?
The CAS number of 2-(2-Bromophenyl)cyclohexa-2,5-diene-1,4-dione is 100125-64-2.
What is the molecular formula of 2-(2-Bromophenyl)cyclohexa-2,5-diene-1,4-dione?
The molecular formula of 2-(2-Bromophenyl)cyclohexa-2,5-diene-1,4-dione is C12H7BrO2.
What is the molecular weight of 2-(2-Bromophenyl)cyclohexa-2,5-diene-1,4-dione?
The molecular weight of 2-(2-Bromophenyl)cyclohexa-2,5-diene-1,4-dione is 261.96295 g/mol.
Where can I buy 2-(2-Bromophenyl)cyclohexa-2,5-diene-1,4-dione?
You can request a quote for 2-(2-Bromophenyl)cyclohexa-2,5-diene-1,4-dione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(2-Bromophenyl)cyclohexa-2,5-diene-1,4-dione?
Yes, CoreyChem provides custom synthesis services for 2-(2-Bromophenyl)cyclohexa-2,5-diene-1,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.