1-Nitro-4-((E)-styryl)-benzene
TL;DR: 1-Nitro-4-((E)-styryl)-benzene (CAS 4003-94-5) is a chemical compound with molecular formula C14H11NO2 and molecular weight 225.07898 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-nitro-4-(2-phenylethenyl)benzene
Also Known As: 4-Nitrostilbene, 4'nitrostilbene, 4'-nitrostilbene, cis-4-Nitrostilbene, cis-4-Mononitrostilbene
Application Areas
Top 5 of 12 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C14H11NO2 |
| Molecular Weight | 225.07898 g/mol |
| XLogP | 4.5 |
| Topological Polar Surface Area (TPSA) | 45.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 225.07898 Da |
| Heavy Atoms | 17 |
| Complexity | 268.0 |
| SMILES | C1=CC=C(C=C1)C=CC2=CC=C(C=C2)[N+](=O)[O-] |
| InChIKey | ZISCOWXWCHUSMH-UHFFFAOYSA-N |
Chemical Property Profile of 1-Nitro-4-((E)-styryl)-benzene
Property Insights of 1-Nitro-4-((E)-styryl)-benzene
The XLogP value of 4.5 indicates that 1-Nitro-4-((E)-styryl)-benzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.8 Ų, 1-Nitro-4-((E)-styryl)-benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Nitro-4-((E)-styryl)-benzene 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
What is the CAS number of 1-Nitro-4-((E)-styryl)-benzene?
The CAS number of 1-Nitro-4-((E)-styryl)-benzene is 4003-94-5.
What is the molecular formula of 1-Nitro-4-((E)-styryl)-benzene?
The molecular formula of 1-Nitro-4-((E)-styryl)-benzene is C14H11NO2.
What is the molecular weight of 1-Nitro-4-((E)-styryl)-benzene?
The molecular weight of 1-Nitro-4-((E)-styryl)-benzene is 225.07898 g/mol.
Where can I buy 1-Nitro-4-((E)-styryl)-benzene?
You can request a quote for 1-Nitro-4-((E)-styryl)-benzene directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-Nitro-4-((E)-styryl)-benzene?
Yes, CoreyChem provides custom synthesis services for 1-Nitro-4-((E)-styryl)-benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.