TL;DR: 4-Aminostyrene (CAS 1520-21-4) is a chemical compound with molecular formula C8H9N and molecular weight 119.0735 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-ethenylaniline
Also Known As: 4-Vinylaniline, 4-Aminostyrene, 4-ethenylaniline, p-Aminostyrene, Benzenamine, 4-ethenyl-
Top 5 of 21 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C8H9N |
| Molecular Weight | 119.0735 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 26.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 119.0735 Da |
| Heavy Atoms | 9 |
| Complexity | 90.0 |
| SMILES | C=CC1=CC=C(C=C1)N |
| InChIKey | LBSXSAXOLABXMF-UHFFFAOYSA-N |
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Aminostyrene. With a topological polar surface area (TPSA) of 26.0 Ų, 4-Aminostyrene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Aminostyrene has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 4-Aminostyrene is 1520-21-4.
The molecular formula of 4-Aminostyrene is C8H9N.
The molecular weight of 4-Aminostyrene is 119.0735 g/mol.
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