Nitrovinylindole
TL;DR: Nitrovinylindole (CAS 1306669-94-2) is a chemical compound with molecular formula C10H8N2O2 and molecular weight 188.05858 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(2-nitroethenyl)-1H-indole
Also Known As: nitrovinylindole, NCIStruc1_000132, NCIStruc2_000264, 2-(2-nitroethenyl)-1h-indole, 2-(2-nitrovinyl)-1H-indole
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C10H8N2O2 |
| Molecular Weight | 188.05858 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 61.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 188.05858 Da |
| Heavy Atoms | 14 |
| Complexity | 247.0 |
| SMILES | C1=CC=C2C(=C1)C=C(N2)C=C[N+](=O)[O-] |
| InChIKey | ZUQXVMIIRIIGTQ-UHFFFAOYSA-N |
Chemical Property Profile of Nitrovinylindole
Property Insights of Nitrovinylindole
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Nitrovinylindole. The TPSA of 61.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Nitrovinylindole. Following Lipinski's Rule of Five, Nitrovinylindole has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Nitrovinylindole?
The CAS number of Nitrovinylindole is 1306669-94-2.
What is the molecular formula of Nitrovinylindole?
The molecular formula of Nitrovinylindole is C10H8N2O2.
What is the molecular weight of Nitrovinylindole?
The molecular weight of Nitrovinylindole is 188.05858 g/mol.
Where can I buy Nitrovinylindole?
You can request a quote for Nitrovinylindole directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Nitrovinylindole?
Yes, CoreyChem provides custom synthesis services for Nitrovinylindole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.