3-(4-Nitrophenyl)prop-2-enamide
TL;DR: 3-(4-Nitrophenyl)prop-2-enamide (CAS 20069-71-0) is a chemical compound with molecular formula C9H8N2O3 and molecular weight 192.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-nitrophenyl)prop-2-enamide
Also Known As: 3-(4-nitrophenyl)prop-2-enamide, (E)-3-(4-nitrophenyl)prop-2-enamide, 2-Propenamide, 3-(4-nitrophenyl)-, (2E)-
| Molecular Formula | C9H8N2O3 |
|---|---|
| Molecular Weight | 192.05 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 88.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 192.0535 |
| Heavy Atoms | 14 |
| Complexity | 249.0 |
Chemical Identifiers
| CAS Number | 20069-71-0 |
|---|---|
| SMILES | C1=CC(=CC=C1C=CC(=O)N)[N+](=O)[O-] |
| InChIKey | OAAPPUXSAOJJCV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(4-Nitrophenyl)prop-2-enamide (CAS 20069-71-0), with molecular formula C9H8N2O3 and molecular weight 192.05 g/mol. IUPAC: 3-(4-nitrophenyl)prop-2-enamide.
Chemical Property Profile of 3-(4-Nitrophenyl)prop-2-enamide
Property Insights of 3-(4-Nitrophenyl)prop-2-enamide
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(4-Nitrophenyl)prop-2-enamide. The TPSA of 88.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(4-Nitrophenyl)prop-2-enamide. Following Lipinski's Rule of Five, 3-(4-Nitrophenyl)prop-2-enamide has 1 hydrogen bond donor(s) and 3 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-(4-Nitrophenyl)prop-2-enamide?
The CAS number of 3-(4-Nitrophenyl)prop-2-enamide is 20069-71-0.
What is the molecular formula of 3-(4-Nitrophenyl)prop-2-enamide?
The molecular formula of 3-(4-Nitrophenyl)prop-2-enamide is C9H8N2O3.
What is the molecular weight of 3-(4-Nitrophenyl)prop-2-enamide?
The molecular weight of 3-(4-Nitrophenyl)prop-2-enamide is 192.05 g/mol.
Where can I buy 3-(4-Nitrophenyl)prop-2-enamide?
You can request a quote for 3-(4-Nitrophenyl)prop-2-enamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-Nitrophenyl)prop-2-enamide?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-Nitrophenyl)prop-2-enamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.