TL;DR: Phenol, 4-ethenyl-, 1-(hydrogen sulfate) (CAS 131351-90-1) is a chemical compound with molecular formula C8H8O4S and molecular weight 200.01433 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(4-ethenylphenyl) hydrogen sulfate
Also Known As: 4-vinylphenol sulfate, 4-Vinylphenol sulphate, 4-Vinylphenol, sulfate, (4-ethenylphenyl) hydrogen sulfate, 4-Vinylphenol sulfuric acid
| Molecular Formula | C8H8O4S |
| Molecular Weight | 200.01433 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 72.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 200.01433 Da |
| Heavy Atoms | 13 |
| Complexity | 256.0 |
| SMILES | C=CC1=CC=C(C=C1)OS(=O)(=O)O |
| InChIKey | IETVQHUKTKKBFF-UHFFFAOYSA-N |
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phenol, 4-ethenyl-, 1-(hydrogen sulfate). The TPSA of 72.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Phenol, 4-ethenyl-, 1-(hydrogen sulfate). Following Lipinski's Rule of Five, Phenol, 4-ethenyl-, 1-(hydrogen sulfate) has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Phenol, 4-ethenyl-, 1-(hydrogen sulfate) is 131351-90-1.
The molecular formula of Phenol, 4-ethenyl-, 1-(hydrogen sulfate) is C8H8O4S.
The molecular weight of Phenol, 4-ethenyl-, 1-(hydrogen sulfate) is 200.01433 g/mol.
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