![4-Nitrotricyclo[6.2.1.0(2,7)]undeca-2,4,6-triene structure](/static/products/422/4228-30-2.png)
4-Nitrotricyclo[6.2.1.0(2,7)]undeca-2,4,6-triene
TL;DR: 4-Nitrotricyclo[6.2.1.0(2,7)]undeca-2,4,6-triene (CAS 4228-30-2) is a chemical compound with molecular formula C11H11NO2 and molecular weight 189.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-nitrotricyclo[6.2.1.02,7]undeca-2(7),3,5-triene
Also Known As: 5-nitrobenzonorbornene, 6-nitro-benzonorbornene, 4-Nitrotricyclo[6.2.1.0(2,7)]undeca-2,4,6-triene
| Molecular Formula | C11H11NO2 |
|---|---|
| Molecular Weight | 189.08 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 45.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 189.07898 |
| Heavy Atoms | 14 |
| Complexity | 261.0 |
Chemical Identifiers
| CAS Number | 4228-30-2 |
|---|---|
| SMILES | C1CC2CC1C3=C2C=C(C=C3)[N+](=O)[O-] |
| InChIKey | PBLSKJQCTXHBEI-UHFFFAOYSA-N |
Product Overview
4-Nitrotricyclo[6.2.1.0(2,7)]undeca-2,4,6-triene (CAS 4228-30-2), with molecular formula C11H11NO2 and molecular weight 189.08 g/mol. IUPAC: 4-nitrotricyclo[6.2.1.02,7]undeca-2(7),3,5-triene.
Chemical Property Profile of 4-Nitrotricyclo[6.2.1.0(2,7)]undeca-2,4,6-triene
Property Insights of 4-Nitrotricyclo[6.2.1.0(2,7)]undeca-2,4,6-triene
The XLogP value of 3.0 indicates that 4-Nitrotricyclo[6.2.1.0(2,7)]undeca-2,4,6-triene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.8 Ų, 4-Nitrotricyclo[6.2.1.0(2,7)]undeca-2,4,6-triene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Nitrotricyclo[6.2.1.0(2,7)]undeca-2,4,6-triene 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
Frequently Asked Questions
What is the CAS number of 4-Nitrotricyclo[6.2.1.0(2,7)]undeca-2,4,6-triene?
The CAS number of 4-Nitrotricyclo[6.2.1.0(2,7)]undeca-2,4,6-triene is 4228-30-2.
What is the molecular formula of 4-Nitrotricyclo[6.2.1.0(2,7)]undeca-2,4,6-triene?
The molecular formula of 4-Nitrotricyclo[6.2.1.0(2,7)]undeca-2,4,6-triene is C11H11NO2.
What is the molecular weight of 4-Nitrotricyclo[6.2.1.0(2,7)]undeca-2,4,6-triene?
The molecular weight of 4-Nitrotricyclo[6.2.1.0(2,7)]undeca-2,4,6-triene is 189.08 g/mol.
Where can I buy 4-Nitrotricyclo[6.2.1.0(2,7)]undeca-2,4,6-triene?
You can request a quote for 4-Nitrotricyclo[6.2.1.0(2,7)]undeca-2,4,6-triene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Nitrotricyclo[6.2.1.0(2,7)]undeca-2,4,6-triene?
Yes, KEHONG BIO provides custom synthesis services for 4-Nitrotricyclo[6.2.1.0(2,7)]undeca-2,4,6-triene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.