![1,3-bis[(E)-2-nitroethenyl]benzene structure](/static/products/4066/40663-63-6.webp)
1,3-bis[(E)-2-nitroethenyl]benzene
TL;DR: 1,3-bis[(E)-2-nitroethenyl]benzene (CAS 40663-63-6) is a chemical compound with molecular formula C10H8N2O4 and molecular weight 220.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-bis[(E)-2-nitroethenyl]benzene
Also Known As: 1,3-bis(2-nitroethenyl)benzene, 1,3-bis[(E)-2-nitroethenyl]benzene, 1,3-bis-(trans-2-nitro-vinyl)-benzene, 1,3-Bis-((E)-2-nitro-vinyl)-benzene, Benzene, 1,3-bis[(1E)-2-nitroethenyl]-, (E,E)-
| Molecular Formula | C10H8N2O4 |
|---|---|
| Molecular Weight | 220.05 g/mol |
| LogP | 2.1814 |
| Topological Polar Surface Area | 86.28 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 220.0484 |
| Heavy Atoms | 16 |
| Complexity | 426.39175 |
Chemical Identifiers
| CAS Number | 40663-63-6 |
|---|---|
| SMILES | C1=CC(=CC(=C1)/C=C/[N+](=O)[O-])/C=C/[N+](=O)[O-] |
Product Overview
1,3-bis[(E)-2-nitroethenyl]benzene (CAS 40663-63-6), with molecular formula C10H8N2O4 and molecular weight 220.05 g/mol. IUPAC: 1,3-bis[(E)-2-nitroethenyl]benzene.
Chemical Property Profile of 1,3-bis[(E)-2-nitroethenyl]benzene
Property Insights of 1,3-bis[(E)-2-nitroethenyl]benzene
The XLogP value of 2.1814 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-bis[(E)-2-nitroethenyl]benzene. The TPSA of 86.28 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3-bis[(E)-2-nitroethenyl]benzene. Following Lipinski's Rule of Five, 1,3-bis[(E)-2-nitroethenyl]benzene 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 1,3-bis[(E)-2-nitroethenyl]benzene?
The CAS number of 1,3-bis[(E)-2-nitroethenyl]benzene is 40663-63-6.
What is the molecular formula of 1,3-bis[(E)-2-nitroethenyl]benzene?
The molecular formula of 1,3-bis[(E)-2-nitroethenyl]benzene is C10H8N2O4.
What is the molecular weight of 1,3-bis[(E)-2-nitroethenyl]benzene?
The molecular weight of 1,3-bis[(E)-2-nitroethenyl]benzene is 220.05 g/mol.
Where can I buy 1,3-bis[(E)-2-nitroethenyl]benzene?
You can request a quote for 1,3-bis[(E)-2-nitroethenyl]benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-bis[(E)-2-nitroethenyl]benzene?
Yes, KEHONG BIO provides custom synthesis services for 1,3-bis[(E)-2-nitroethenyl]benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.