3-((1Z)-2-bromo-2-nitrovinyl)-1-nitrobenzene
TL;DR: 3-((1Z)-2-bromo-2-nitrovinyl)-1-nitrobenzene (CAS 39773-86-9) is a chemical compound with molecular formula C8H5BrN2O4 and molecular weight 271.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(Z)-2-bromo-2-nitroethenyl]-3-nitrobenzene
Also Known As: 1-(2-bromo-2-nitroethenyl)-3-nitrobenzene, 1-(2-Bromo-2-nitro-vinyl)-3-nitro-benzene, 1-[(Z)-2-bromo-2-nitroethenyl]-3-nitrobenzene, 3-((1Z)-2-bromo-2-nitrovinyl)-1-nitrobenzene
| Molecular Formula | C8H5BrN2O4 |
|---|---|
| Molecular Weight | 271.94 g/mol |
| LogP | 2.5648 |
| Topological Polar Surface Area | 86.28 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 271.94327 |
| Heavy Atoms | 15 |
| Complexity | 444.02274 |
Chemical Identifiers
| CAS Number | 39773-86-9 |
|---|---|
| SMILES | C1=CC(=CC(=C1)[N+](=O)[O-])/C=C(/[N+](=O)[O-])\Br |
Product Overview
3-((1Z)-2-bromo-2-nitrovinyl)-1-nitrobenzene (CAS 39773-86-9), with molecular formula C8H5BrN2O4 and molecular weight 271.94 g/mol. IUPAC: 1-[(Z)-2-bromo-2-nitroethenyl]-3-nitrobenzene.
Chemical Property Profile of 3-((1Z)-2-bromo-2-nitrovinyl)-1-nitrobenzene
Property Insights of 3-((1Z)-2-bromo-2-nitrovinyl)-1-nitrobenzene
The XLogP value of 2.5648 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-((1Z)-2-bromo-2-nitrovinyl)-1-nitrobenzene. The TPSA of 86.28 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-((1Z)-2-bromo-2-nitrovinyl)-1-nitrobenzene. Following Lipinski's Rule of Five, 3-((1Z)-2-bromo-2-nitrovinyl)-1-nitrobenzene has 0 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 3-((1Z)-2-bromo-2-nitrovinyl)-1-nitrobenzene?
The CAS number of 3-((1Z)-2-bromo-2-nitrovinyl)-1-nitrobenzene is 39773-86-9.
What is the molecular formula of 3-((1Z)-2-bromo-2-nitrovinyl)-1-nitrobenzene?
The molecular formula of 3-((1Z)-2-bromo-2-nitrovinyl)-1-nitrobenzene is C8H5BrN2O4.
What is the molecular weight of 3-((1Z)-2-bromo-2-nitrovinyl)-1-nitrobenzene?
The molecular weight of 3-((1Z)-2-bromo-2-nitrovinyl)-1-nitrobenzene is 271.94 g/mol.
Where can I buy 3-((1Z)-2-bromo-2-nitrovinyl)-1-nitrobenzene?
You can request a quote for 3-((1Z)-2-bromo-2-nitrovinyl)-1-nitrobenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-((1Z)-2-bromo-2-nitrovinyl)-1-nitrobenzene?
Yes, KEHONG BIO provides custom synthesis services for 3-((1Z)-2-bromo-2-nitrovinyl)-1-nitrobenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.