2-bromo-6-methoxy-4-(2-nitroethenyl)phenol
TL;DR: 2-bromo-6-methoxy-4-(2-nitroethenyl)phenol (CAS 54291-89-3) is a chemical compound with molecular formula C9H8BrNO4 and molecular weight 272.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-bromo-6-methoxy-4-(2-nitroethenyl)phenol
Also Known As: 2-bromo-6-methoxy-4-(2-nitroethenyl)phenol, 2-bromo-6-methoxy-4-[(E)-2-nitroethenyl]phenol
| Molecular Formula | C9H8BrNO4 |
|---|---|
| Molecular Weight | 272.96 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 75.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 272.96368 |
| Heavy Atoms | 15 |
| Complexity | 253.0 |
Chemical Identifiers
| CAS Number | 54291-89-3 |
|---|---|
| SMILES | COC1=C(C(=CC(=C1)C=C[N+](=O)[O-])Br)O |
| InChIKey | VJLCVLQWILPELK-UHFFFAOYSA-N |
Product Overview
2-bromo-6-methoxy-4-(2-nitroethenyl)phenol (CAS 54291-89-3), with molecular formula C9H8BrNO4 and molecular weight 272.96 g/mol. IUPAC: 2-bromo-6-methoxy-4-(2-nitroethenyl)phenol.
Chemical Property Profile of 2-bromo-6-methoxy-4-(2-nitroethenyl)phenol
Property Insights of 2-bromo-6-methoxy-4-(2-nitroethenyl)phenol
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-bromo-6-methoxy-4-(2-nitroethenyl)phenol. The TPSA of 75.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-bromo-6-methoxy-4-(2-nitroethenyl)phenol. Following Lipinski's Rule of Five, 2-bromo-6-methoxy-4-(2-nitroethenyl)phenol has 1 hydrogen bond donor(s) and 4 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-bromo-6-methoxy-4-(2-nitroethenyl)phenol?
The CAS number of 2-bromo-6-methoxy-4-(2-nitroethenyl)phenol is 54291-89-3.
What is the molecular formula of 2-bromo-6-methoxy-4-(2-nitroethenyl)phenol?
The molecular formula of 2-bromo-6-methoxy-4-(2-nitroethenyl)phenol is C9H8BrNO4.
What is the molecular weight of 2-bromo-6-methoxy-4-(2-nitroethenyl)phenol?
The molecular weight of 2-bromo-6-methoxy-4-(2-nitroethenyl)phenol is 272.96 g/mol.
Where can I buy 2-bromo-6-methoxy-4-(2-nitroethenyl)phenol?
You can request a quote for 2-bromo-6-methoxy-4-(2-nitroethenyl)phenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-bromo-6-methoxy-4-(2-nitroethenyl)phenol?
Yes, KEHONG BIO provides custom synthesis services for 2-bromo-6-methoxy-4-(2-nitroethenyl)phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.