1-Bromo-4-methoxy-2-(2-nitroethenyl)benzene
TL;DR: 1-Bromo-4-methoxy-2-(2-nitroethenyl)benzene (CAS 1326308-26-2) is a chemical compound with molecular formula C9H8BrNO3 and molecular weight 256.96875 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-bromo-4-methoxy-2-[(E)-2-nitroethenyl]benzene
Also Known As: 1-bromo-4-methoxy-2-(2-nitroethenyl)benzene, 1-bromo-4-methoxy-2-[(E)-2-nitroethenyl]benzene
Technical Specifications
| Molecular Formula | C9H8BrNO3 |
| Molecular Weight | 256.96875 g/mol |
| XLogP | 2.8 |
| Topological Polar Surface Area (TPSA) | 55.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 256.96875 Da |
| Heavy Atoms | 14 |
| Complexity | 227.0 |
| SMILES | COC1=CC(=C(C=C1)Br)/C=C/[N+](=O)[O-] |
| InChIKey | BCWXSXJUZCSSEI-SNAWJCMRSA-N |
Chemical Property Profile of 1-Bromo-4-methoxy-2-(2-nitroethenyl)benzene
Property Insights of 1-Bromo-4-methoxy-2-(2-nitroethenyl)benzene
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Bromo-4-methoxy-2-(2-nitroethenyl)benzene. With a topological polar surface area (TPSA) of 55.1 Ų, 1-Bromo-4-methoxy-2-(2-nitroethenyl)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Bromo-4-methoxy-2-(2-nitroethenyl)benzene 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 1-Bromo-4-methoxy-2-(2-nitroethenyl)benzene?
The CAS number of 1-Bromo-4-methoxy-2-(2-nitroethenyl)benzene is 1326308-26-2.
What is the molecular formula of 1-Bromo-4-methoxy-2-(2-nitroethenyl)benzene?
The molecular formula of 1-Bromo-4-methoxy-2-(2-nitroethenyl)benzene is C9H8BrNO3.
What is the molecular weight of 1-Bromo-4-methoxy-2-(2-nitroethenyl)benzene?
The molecular weight of 1-Bromo-4-methoxy-2-(2-nitroethenyl)benzene is 256.96875 g/mol.
Where can I buy 1-Bromo-4-methoxy-2-(2-nitroethenyl)benzene?
You can request a quote for 1-Bromo-4-methoxy-2-(2-nitroethenyl)benzene directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-Bromo-4-methoxy-2-(2-nitroethenyl)benzene?
Yes, CoreyChem provides custom synthesis services for 1-Bromo-4-methoxy-2-(2-nitroethenyl)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.