![3-[2-(4-Nitrobenzenesulfonyl)ethenyl]thiophene structure](/static/products/1351/1351504-86-3.webp)
3-[2-(4-Nitrobenzenesulfonyl)ethenyl]thiophene
TL;DR: 3-[2-(4-Nitrobenzenesulfonyl)ethenyl]thiophene (CAS 1351504-86-3) is a chemical compound with molecular formula C12H9NO4S2 and molecular weight 294.9973 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[(E)-2-(4-nitrophenyl)sulfonylethenyl]thiophene
Also Known As: 3-[2-(4-nitrobenzenesulfonyl)ethenyl]thiophene, AB00986138-01, 3-[(E)-2-(4-nitrophenyl)sulfonylethenyl]thiophene
Technical Specifications
| Molecular Formula | C12H9NO4S2 |
| Molecular Weight | 294.9973 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 117.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 294.9973 Da |
| Heavy Atoms | 19 |
| Complexity | 441.0 |
| SMILES | C1=CC(=CC=C1[N+](=O)[O-])S(=O)(=O)/C=C/C2=CSC=C2 |
| InChIKey | IQKWIWSTANYYPQ-SOFGYWHQSA-N |
Chemical Property Profile of 3-[2-(4-Nitrobenzenesulfonyl)ethenyl]thiophene
Property Insights of 3-[2-(4-Nitrobenzenesulfonyl)ethenyl]thiophene
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[2-(4-Nitrobenzenesulfonyl)ethenyl]thiophene. The TPSA of 117.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[2-(4-Nitrobenzenesulfonyl)ethenyl]thiophene. Following Lipinski's Rule of Five, 3-[2-(4-Nitrobenzenesulfonyl)ethenyl]thiophene has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-[2-(4-Nitrobenzenesulfonyl)ethenyl]thiophene?
The CAS number of 3-[2-(4-Nitrobenzenesulfonyl)ethenyl]thiophene is 1351504-86-3.
What is the molecular formula of 3-[2-(4-Nitrobenzenesulfonyl)ethenyl]thiophene?
The molecular formula of 3-[2-(4-Nitrobenzenesulfonyl)ethenyl]thiophene is C12H9NO4S2.
What is the molecular weight of 3-[2-(4-Nitrobenzenesulfonyl)ethenyl]thiophene?
The molecular weight of 3-[2-(4-Nitrobenzenesulfonyl)ethenyl]thiophene is 294.9973 g/mol.
Where can I buy 3-[2-(4-Nitrobenzenesulfonyl)ethenyl]thiophene?
You can request a quote for 3-[2-(4-Nitrobenzenesulfonyl)ethenyl]thiophene directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-[2-(4-Nitrobenzenesulfonyl)ethenyl]thiophene?
Yes, CoreyChem provides custom synthesis services for 3-[2-(4-Nitrobenzenesulfonyl)ethenyl]thiophene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.